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

Systemtic Name: 1-(3-methylbutanoyl)-4-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 4-benzyl-1-(3-methylbutanoyl)piperidine-4-carboxylic acid CAS Name: 1-(3-methyl-1-oxobutyl)-4-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-benzyl-1-(3-methylbutanoyl)piperidine-4-carboxylic acid Traditional Name: 4-benzyl-1-isovaleryl-isonipecotic acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO3/c1-14(2)12-16(20)19-10-8-18(9-11-19,17(21)22)13-15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,21,22)