3-phenylpropyl 5-oxidanylidene-5-[(phenylmethyl)amino]pentanoate

Systemtic Name: 3-phenylpropyl 5-oxidanylidene-5-[(phenylmethyl)amino]pentanoate Openeye Name: 3-phenylpropyl 5-(benzylamino)-5-oxo-pentanoate CAS Name: 5-oxo-5-[(phenylmethyl)amino]pentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-(benzylamino)-5-oxopentanoate Traditional Name: 5-(benzylamino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO3/c23-20(22-17-19-11-5-2-6-12-19)14-7-15-21(24)25-16-8-13-18-9-3-1-4-10-18/h1-6,9-12H,7-8,13-17H2,(H,22,23)