3-phenylpropyl 5-oxidanylidene-5-[(4-prop-2-enoxyphenyl)amino]pentanoate

Systemtic Name: 3-phenylpropyl 5-oxidanylidene-5-[(4-prop-2-enoxyphenyl)amino]pentanoate Openeye Name: 3-phenylpropyl 5-(4-allyloxyanilino)-5-oxo-pentanoate CAS Name: 5-oxo-5-(4-prop-2-enoxyanilino)pentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-oxo-5-(4-prop-2-enoxyanilino)pentanoate Traditional Name: 5-(4-allyloxyanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

C=CCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C23H27NO4/c1-2-17-27-21-15-13-20(14-16-21)24-22(25)11-6-12-23(26)28-18-7-10-19-8-4-3-5-9-19/h2-5,8-9,13-16H,1,6-7,10-12,17-18H2,(H,24,25)