4-(phenylmethyl)-1-propanoyl-piperidine-4-carboxylic acid

Systemtic Name: 4-(phenylmethyl)-1-propanoyl-piperidine-4-carboxylic acid Openeye Name: 4-benzyl-1-propanoyl-piperidine-4-carboxylic acid CAS Name: 1-(1-oxopropyl)-4-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-benzyl-1-propanoylpiperidine-4-carboxylic acid Traditional Name: 4-benzyl-1-propionyl-isonipecotic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1)(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC(=O)N1CCC(CC1)(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H21NO3/c1-2-14(18)17-10-8-16(9-11-17,15(19)20)12-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,19,20)