2-(3-methylbutanoyl)-1-phenylazanyl-piperidine-4-carboxylic acid

Systemtic Name: 2-(3-methylbutanoyl)-1-phenylazanyl-piperidine-4-carboxylic acid Openeye Name: 1-anilino-2-(3-methylbutanoyl)piperidine-4-carboxylic acid CAS Name: 1-anilino-2-(3-methyl-1-oxobutyl)-4-piperidinecarboxylic acid IUPAC Name: 1-anilino-2-(3-methylbutanoyl)piperidine-4-carboxylic acid Traditional Name: 1-anilino-2-isovaleryl-isonipecotic acid Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1CC(CCN1NC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(=O)C1CC(CCN1NC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H24N2O3/c1-12(2)10-16(20)15-11-13(17(21)22)8-9-19(15)18-14-6-4-3-5-7-14/h3-7,12-13,15,18H,8-11H2,1-2H3,(H,21,22)