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

Systemtic Name: 3-phenylpropyl 5-[(4-hexoxyphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-(4-hexoxyanilino)-5-oxo-pentanoate CAS Name: 5-(4-hexoxyanilino)-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-(4-hexoxyanilino)-5-oxopentanoate Traditional Name: 5-(4-hexoxyanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C26H35NO4/c1-2-3-4-8-20-30-24-18-16-23(17-19-24)27-25(28)14-9-15-26(29)31-21-10-13-22-11-6-5-7-12-22/h5-7,11-12,16-19H,2-4,8-10,13-15,20-21H2,1H3,(H,27,28)