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

Systemtic Name: 3-phenylpropyl 5-[[4-(2-methylpropanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[4-(2-methylpropanoylamino)anilino]-5-oxo-pentanoate CAS Name: 5-[4-[(2-methyl-1-oxopropyl)amino]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-(2-methylpropanoylamino)anilino]-5-oxopentanoate Traditional Name: 5-[4-(isobutyrylamino)anilino]-5-keto-valeric acid 3-phenylpropyl ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O4/c1-18(2)24(29)26-21-15-13-20(14-16-21)25-22(27)11-6-12-23(28)30-17-7-10-19-8-4-3-5-9-19/h3-5,8-9,13-16,18H,6-7,10-12,17H2,1-2H3,(H,25,27)(H,26,29)