1-[4-oxidanylidene-4-[[(2S)-4-phenylbutan-2-yl]amino]butanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[4-oxidanylidene-4-[[(2S)-4-phenylbutan-2-yl]amino]butanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[4-[[(1S)-1-methyl-3-phenyl-propyl]amino]-4-oxo-butanoyl]piperidine-4-carboxylic acid CAS Name: 1-[1,4-dioxo-4-[[(2S)-4-phenylbutan-2-yl]amino]butyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-oxo-4-[[(2S)-4-phenylbutan-2-yl]amino]butanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[4-keto-4-[[(1S)-1-methyl-3-phenyl-propyl]amino]butanoyl]isonipecotic acid Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CCC(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

C[C@@H](CCC1=CC=CC=C1)NC(=O)CCC(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C20H28N2O4/c1-15(7-8-16-5-3-2-4-6-16)21-18(23)9-10-19(24)22-13-11-17(12-14-22)20(25)26/h2-6,15,17H,7-14H2,1H3,(H,21,23)(H,25,26)/t15-/m0/s1