cyanomethyl 2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: cyanomethyl 2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: cyanomethyl 2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-3-(1H-indol-3-yl)propionic acid cyanomethyl ester Formula: C19H16ClN3O4S MolecularWeight: 417.86604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC#N)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC#N)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClN3O4S/c20-14-5-7-15(8-6-14)28(25,26)23-18(19(24)27-10-9-21)11-13-12-22-17-4-2-1-3-16(13)17/h1-8,12,18,22-23H,10-11H2