ethyl 1-[2-oxidanylidene-2-[[2-(phenylcarbamoyl)phenyl]amino]ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[2-oxidanylidene-2-[[2-(phenylcarbamoyl)phenyl]amino]ethyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[2-[anilino(oxo)methyl]anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-[2-(phenylcarbamoyl)anilino]ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O4/c1-2-30-23(29)17-12-14-26(15-13-17)16-21(27)25-20-11-7-6-10-19(20)22(28)24-18-8-4-3-5-9-18/h3-11,17H,2,12-16H2,1H3,(H,24,28)(H,25,27)/p+1