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

Systemtic Name: 3-phenylpropyl 4-oxidanylidene-4-[(3-prop-2-enoxyphenyl)amino]butanoate Openeye Name: 3-phenylpropyl 4-(3-allyloxyanilino)-4-oxo-butanoate CAS Name: 4-oxo-4-(3-prop-2-enoxyanilino)butanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-oxo-4-(3-prop-2-enoxyanilino)butanoate Traditional Name: 4-(3-allyloxyanilino)-4-keto-butyric acid 3-phenylpropyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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