3-phenylpropyl 5-[[3-(2,2-dimethylpropanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[3-(2,2-dimethylpropanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[3-(2,2-dimethylpropanoylamino)anilino]-5-oxo-pentanoate CAS Name: 5-[3-[(2,2-dimethyl-1-oxopropyl)amino]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[3-(2,2-dimethylpropanoylamino)anilino]-5-oxopentanoate Traditional Name: 5-keto-5-[3-(pivaloylamino)anilino]valeric acid 3-phenylpropyl ester Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O4/c1-25(2,3)24(30)27-21-14-7-13-20(18-21)26-22(28)15-8-16-23(29)31-17-9-12-19-10-5-4-6-11-19/h4-7,10-11,13-14,18H,8-9,12,15-17H2,1-3H3,(H,26,28)(H,27,30)