5-methyl-2,4-bis(oxidanylidene)-1-phenethyl-piperidine-3-carboxylic acid

Systemtic Name: 5-methyl-2,4-bis(oxidanylidene)-1-phenethyl-piperidine-3-carboxylic acid Openeye Name: 5-methyl-2,4-dioxo-1-phenethyl-piperidine-3-carboxylic acid CAS Name: 5-methyl-2,4-dioxo-1-phenethyl-3-piperidinecarboxylic acid IUPAC Name: 5-methyl-2,4-dioxo-1-phenethylpiperidine-3-carboxylic acid Traditional Name: 2,4-diketo-5-methyl-1-phenethyl-nipecotic acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(=O)C(C1=O)C(=O)O)CCC2=CC=CC=C2

Isomeric SMILES

CC1CN(C(=O)C(C1=O)C(=O)O)CCC2=CC=CC=C2

InChI

InChI=1S/C15H17NO4/c1-10-9-16(8-7-11-5-3-2-4-6-11)14(18)12(13(10)17)15(19)20/h2-6,10,12H,7-9H2,1H3,(H,19,20)