3-phenylpropyl 5-[(4-ethanoylphenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[(4-ethanoylphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-(4-acetylanilino)-5-oxo-pentanoate CAS Name: 5-(4-acetylanilino)-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-(4-acetylanilino)-5-oxopentanoate Traditional Name: 5-(4-acetylanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO4/c1-17(24)19-12-14-20(15-13-19)23-21(25)10-5-11-22(26)27-16-6-9-18-7-3-2-4-8-18/h2-4,7-8,12-15H,5-6,9-11,16H2,1H3,(H,23,25)