methyl 3-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[4-[(4-methyl-1-piperidyl)sulfonyl]anilino]-3-oxo-propanoate CAS Name: 3-[4-[(4-methyl-1-piperidinyl)sulfonyl]anilino]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(4-methylpiperidin-1-yl)sulfonylanilino]-3-oxopropanoate Traditional Name: 3-keto-3-[4-(4-methylpiperidino)sulfonylanilino]propionic acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC(=O)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC(=O)OC

InChI

InChI=1S/C16H22N2O5S/c1-12-7-9-18(10-8-12)24(21,22)14-5-3-13(4-6-14)17-15(19)11-16(20)23-2/h3-6,12H,7-11H2,1-2H3,(H,17,19)