methyl 4-[2-cyanoethyl-(phenylmethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-cyanoethyl-(phenylmethyl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[benzyl(2-cyanoethyl)amino]-4-oxo-butanoate CAS Name: 4-[2-cyanoethyl-(phenylmethyl)amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[benzyl(2-cyanoethyl)amino]-4-oxobutanoate Traditional Name: 4-[benzyl(2-cyanoethyl)amino]-4-keto-butyric acid methyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)N(CCC#N)CC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCC(=O)N(CCC#N)CC1=CC=CC=C1

InChI

InChI=1S/C15H18N2O3/c1-20-15(19)9-8-14(18)17(11-5-10-16)12-13-6-3-2-4-7-13/h2-4,6-7H,5,8-9,11-12H2,1H3