methyl 3-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 3-(4-indolin-1-ylsulfonylanilino)-3-oxo-propanoate CAS Name: 3-[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-3-oxopropanoate Traditional Name: 3-(4-indolin-1-ylsulfonylanilino)-3-keto-propionic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32

Isomeric SMILES

COC(=O)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C18H18N2O5S/c1-25-18(22)12-17(21)19-14-6-8-15(9-7-14)26(23,24)20-11-10-13-4-2-3-5-16(13)20/h2-9H,10-12H2,1H3,(H,19,21)