methyl 1-[2,2-bis(2-hydroxyphenyl)ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-[2,2-bis(2-hydroxyphenyl)ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Openeye Name: methyl 1-[2,2-bis(2-hydroxyphenyl)ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate CAS Name: 1-[2,2-bis(2-hydroxyphenyl)ethyl]-3-[(phenoxysulfonylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2,2-bis(2-hydroxyphenyl)ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Traditional Name: 1-[2,2-bis(2-hydroxyphenyl)ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C31H28N2O7S MolecularWeight: 572.62822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=C2CNS(=O)(=O)OC3=CC=CC=C3)CC(C4=CC=CC=C4O)C5=CC=CC=C5O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=C2CNS(=O)(=O)OC3=CC=CC=C3)CC(C4=CC=CC=C4O)C5=CC=CC=C5O

InChI

InChI=1S/C31H28N2O7S/c1-39-31(36)21-15-16-28-26(17-21)22(18-32-41(37,38)40-23-9-3-2-4-10-23)19-33(28)20-27(24-11-5-7-13-29(24)34)25-12-6-8-14-30(25)35/h2-17,19,27,32,34-35H,18,20H2,1H3