5,10,15-Tris(4-tert-butylphenyl) corrole
HIT219586469
sdf文件结构编辑类似物检索
HIT ID: HIT219586469
Cas No: 958259-08-0
分子式: C49H50N4
分子量: 694.967
常用名: 5,10,15-Tris(4-tert-butylphenyl) corrole
常用名: 5,10,15-Tris(4-tert-butylphenyl) corrole
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6,11,16-tris(4-tert-butylphenyl)-20,21,22,23-tetraazapentacyclo[15.2.1.1^{2,5}.1^{7,10}.1^{12,15}]tricosa-1(19),2,4,6,8,10,12(21),13,15,17-decaene
IUPAC: 6,11,16-tris(4-tert-butylphenyl)-20,21,22,23-tetraazapentacyclo[15.2.1.1^{2,5}.1^{7,10}.1^{12,15}]tricosa-1(19),2,4,6,8,10,12(21),13,15,17-decaene
SMILES: CC(C)(C)c1ccc(cc1)-c1c2ccc(n2)c(-c2ccc(cc2)C(C)(C)C)c2ccc([nH]2)c2ccc([nH]2)c(-c2ccc(cc2)C(C)(C)C)c2ccc1[nH]2
SMILES: CC(C)(C)c1ccc(cc1)-c1c2ccc(n2)c(-c2ccc(cc2)C(C)(C)C)c2ccc([nH]2)c2ccc([nH]2)c(-c2ccc(cc2)C(C)(C)C)c2ccc1[nH]2
InChI key: SHXXMVCVSAVCEH-WPXWEGTBSA-N
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