3-phenylpropyl 5-[[4-(2-methylpropoxy)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[4-(2-methylpropoxy)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-(4-isobutoxyanilino)-5-oxo-pentanoate CAS Name: 5-[4-(2-methylpropoxy)anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-(2-methylpropoxy)anilino]-5-oxopentanoate Traditional Name: 5-(4-isobutoxyanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO4/c1-19(2)18-29-22-15-13-21(14-16-22)25-23(26)11-6-12-24(27)28-17-7-10-20-8-4-3-5-9-20/h3-5,8-9,13-16,19H,6-7,10-12,17-18H2,1-2H3,(H,25,26)