methyl 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate Openeye Name: methyl 4-(benzylamino)-4-oxo-butanoate CAS Name: 4-oxo-4-[(phenylmethyl)amino]butanoic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-4-oxobutanoate Traditional Name: 4-(benzylamino)-4-keto-butyric acid methyl ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C12H15NO3/c1-16-12(15)8-7-11(14)13-9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,14)