3-phenylpropyl 4-[[4-(2-cyclohexylethoxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[[4-(2-cyclohexylethoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[4-(2-cyclohexylethoxy)anilino]-4-oxo-butanoate CAS Name: 4-[4-(2-cyclohexylethoxy)anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[4-(2-cyclohexylethoxy)anilino]-4-oxobutanoate Traditional Name: 4-[4-(2-cyclohexylethoxy)anilino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C27H35NO4 MolecularWeight: 437.5711

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCOC2=CC=C(C=C2)NC(=O)CCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)CCOC2=CC=C(C=C2)NC(=O)CCC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C27H35NO4/c29-26(17-18-27(30)32-20-7-12-22-8-3-1-4-9-22)28-24-13-15-25(16-14-24)31-21-19-23-10-5-2-6-11-23/h1,3-4,8-9,13-16,23H,2,5-7,10-12,17-21H2,(H,28,29)