ethyl 3-[3-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonyl]propanoylamino]benzoate

Systemtic Name: ethyl 3-[3-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonyl]propanoylamino]benzoate Openeye Name: ethyl 3-[3-(1-methyl-2-oxo-indolin-5-yl)sulfonylpropanoylamino]benzoate CAS Name: 3-[[3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]propanoylamino]benzoate Traditional Name: 3-[3-(2-keto-1-methyl-indolin-5-yl)sulfonylpropanoylamino]benzoic acid ethyl ester Formula: C21H22N2O6S MolecularWeight: 430.47418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C

InChI

InChI=1S/C21H22N2O6S/c1-3-29-21(26)14-5-4-6-16(11-14)22-19(24)9-10-30(27,28)17-7-8-18-15(12-17)13-20(25)23(18)2/h4-8,11-12H,3,9-10,13H2,1-2H3,(H,22,24)