3-phenylpropyl 5-[(4-methylphenyl)methylamino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[(4-methylphenyl)methylamino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-oxo-5-(p-tolylmethylamino)pentanoate CAS Name: 5-[(4-methylphenyl)methylamino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[(4-methylphenyl)methylamino]-5-oxopentanoate Traditional Name: 5-keto-5-[(4-methylbenzyl)amino]valeric acid 3-phenylpropyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO3/c1-18-12-14-20(15-13-18)17-23-21(24)10-5-11-22(25)26-16-6-9-19-7-3-2-4-8-19/h2-4,7-8,12-15H,5-6,9-11,16-17H2,1H3,(H,23,24)