(2S)-2-[(1-ethanoyl-4-phenyl-piperidin-4-yl)carbonylamino]butanedioic acid

Systemtic Name: (2S)-2-[(1-ethanoyl-4-phenyl-piperidin-4-yl)carbonylamino]butanedioic acid Openeye Name: (2S)-2-[(1-acetyl-4-phenyl-piperidine-4-carbonyl)amino]butanedioic acid CAS Name: (2S)-2-[[(1-acetyl-4-phenyl-4-piperidinyl)-oxomethyl]amino]butanedioic acid IUPAC Name: (2S)-2-[(1-acetyl-4-phenylpiperidine-4-carbonyl)amino]butanedioic acid Traditional Name: (2S)-2-[(1-acetyl-4-phenyl-isonipecotoyl)amino]succinic acid Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)N[C@@H](CC(=O)O)C(=O)O

InChI

InChI=1S/C18H22N2O6/c1-12(21)20-9-7-18(8-10-20,13-5-3-2-4-6-13)17(26)19-14(16(24)25)11-15(22)23/h2-6,14H,7-11H2,1H3,(H,19,26)(H,22,23)(H,24,25)/t14-/m0/s1