3-phenylpropyl 4-[(4-methylphenyl)methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[(4-methylphenyl)methylamino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-oxo-4-(p-tolylmethylamino)butanoate CAS Name: 4-[(4-methylphenyl)methylamino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[(4-methylphenyl)methylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[(4-methylbenzyl)amino]butyric acid 3-phenylpropyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO3/c1-17-9-11-19(12-10-17)16-22-20(23)13-14-21(24)25-15-5-8-18-6-3-2-4-7-18/h2-4,6-7,9-12H,5,8,13-16H2,1H3,(H,22,23)