3-[(4-hydroxyphenyl)methyl]-2-methyl-1-(4-phenylphenyl)carbonyl-indole-5-sulfonic acid

Systemtic Name: 3-[(4-hydroxyphenyl)methyl]-2-methyl-1-(4-phenylphenyl)carbonyl-indole-5-sulfonic acid Openeye Name: 3-[(4-hydroxyphenyl)methyl]-2-methyl-1-(4-phenylbenzoyl)indole-5-sulfonic acid CAS Name: 3-[(4-hydroxyphenyl)methyl]-2-methyl-1-[oxo-(4-phenylphenyl)methyl]-5-indolesulfonic acid IUPAC Name: 3-[(4-hydroxyphenyl)methyl]-2-methyl-1-(4-phenylbenzoyl)indole-5-sulfonic acid Traditional Name: 3-(4-hydroxybenzyl)-2-methyl-1-(4-phenylbenzoyl)indole-5-sulfonic acid Formula: C29H23NO5S MolecularWeight: 497.56162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C=CC(=C2)S(=O)(=O)O)CC5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C=CC(=C2)S(=O)(=O)O)CC5=CC=C(C=C5)O

InChI

InChI=1S/C29H23NO5S/c1-19-26(17-20-7-13-24(31)14-8-20)27-18-25(36(33,34)35)15-16-28(27)30(19)29(32)23-11-9-22(10-12-23)21-5-3-2-4-6-21/h2-16,18,31H,17H2,1H3,(H,33,34,35)