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

Systemtic Name: 3-phenylpropyl 4-[2-cyanoethyl-(phenylmethyl)amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[benzyl(2-cyanoethyl)amino]-4-oxo-butanoate CAS Name: 4-[2-cyanoethyl-(phenylmethyl)amino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[benzyl(2-cyanoethyl)amino]-4-oxobutanoate Traditional Name: 4-[benzyl(2-cyanoethyl)amino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCC(=O)N(CCC#N)CC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCC(=O)N(CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C23H26N2O3/c24-16-8-17-25(19-21-11-5-2-6-12-21)22(26)14-15-23(27)28-18-7-13-20-9-3-1-4-10-20/h1-6,9-12H,7-8,13-15,17-19H2