1-ethoxycarbonyl-3-(phenylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 1-ethoxycarbonyl-3-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 3-benzyl-1-ethoxycarbonyl-piperidine-4-carboxylic acid CAS Name: 1-ethoxycarbonyl-3-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 3-benzyl-1-ethoxycarbonylpiperidine-4-carboxylic acid Traditional Name: 3-benzyl-1-carbethoxy-isonipecotic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(C(C1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCOC(=O)N1CCC(C(C1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-2-21-16(20)17-9-8-14(15(18)19)13(11-17)10-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11H2,1H3,(H,18,19)