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

Systemtic Name: 3-phenylpropyl 4-[[4-(2-methylpropoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-(4-isobutoxyanilino)-4-oxo-butanoate CAS Name: 4-[4-(2-methylpropoxy)anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[4-(2-methylpropoxy)anilino]-4-oxobutanoate Traditional Name: 4-(4-isobutoxyanilino)-4-keto-butyric acid 3-phenylpropyl ester Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C23H29NO4/c1-18(2)17-28-21-12-10-20(11-13-21)24-22(25)14-15-23(26)27-16-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-13,18H,6,9,14-17H2,1-2H3,(H,24,25)