(phenylmethyl) 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (phenylmethyl) 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: benzyl 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-indol-3-yl)propionic acid benzyl ester Formula: C31H27N3O5S MolecularWeight: 553.62818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3O5S/c35-30(23-11-5-2-6-12-23)33-25-15-17-26(18-16-25)40(37,38)34-29(31(36)39-21-22-9-3-1-4-10-22)19-24-20-32-28-14-8-7-13-27(24)28/h1-18,20,29,32,34H,19,21H2,(H,33,35)