methyl 1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]-3-(phenylsulfonylaminomethyl)indole-5-carboxylate

Systemtic Name: methyl 1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]-3-(phenylsulfonylaminomethyl)indole-5-carboxylate Openeye Name: methyl 3-(benzenesulfonamidomethyl)-1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]indole-5-carboxylate CAS Name: 3-(benzenesulfonamidomethyl)-1-[2-(2-hydroxyphenyl)-2-phenylethyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonamidomethyl)-1-[2-(2-hydroxyphenyl)-2-phenylethyl]indole-5-carboxylate Traditional Name: 3-(benzenesulfonamidomethyl)-1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]indole-5-carboxylic acid methyl ester Formula: C31H28N2O5S MolecularWeight: 540.62942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=C2CNS(=O)(=O)C3=CC=CC=C3)CC(C4=CC=CC=C4)C5=CC=CC=C5O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=C2CNS(=O)(=O)C3=CC=CC=C3)CC(C4=CC=CC=C4)C5=CC=CC=C5O

InChI

InChI=1S/C31H28N2O5S/c1-38-31(35)23-16-17-29-27(18-23)24(19-32-39(36,37)25-12-6-3-7-13-25)20-33(29)21-28(22-10-4-2-5-11-22)26-14-8-9-15-30(26)34/h2-18,20,28,32,34H,19,21H2,1H3