methyl (3R)-4-[(2-nitrophenyl)amino]-4-oxidanylidene-3-piperidin-1-yl-butanoate

Systemtic Name: methyl (3R)-4-[(2-nitrophenyl)amino]-4-oxidanylidene-3-piperidin-1-yl-butanoate Openeye Name: methyl (3R)-4-(2-nitroanilino)-4-oxo-3-(1-piperidyl)butanoate CAS Name: (3R)-4-(2-nitroanilino)-4-oxo-3-(1-piperidinyl)butanoic acid methyl ester IUPAC Name: methyl (3R)-4-(2-nitroanilino)-4-oxo-3-piperidin-1-ylbutanoate Traditional Name: (3R)-4-keto-4-(2-nitroanilino)-3-piperidino-butyric acid methyl ester Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

COC(=O)C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C16H21N3O5/c1-24-15(20)11-14(18-9-5-2-6-10-18)16(21)17-12-7-3-4-8-13(12)19(22)23/h3-4,7-8,14H,2,5-6,9-11H2,1H3,(H,17,21)/t14-/m1/s1