phenethyl 4-[[4-(2-methylpropanoylamino)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[[4-(2-methylpropanoylamino)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[4-(2-methylpropanoylamino)anilino]-4-oxo-butanoate CAS Name: 4-[4-[(2-methyl-1-oxopropyl)amino]anilino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[4-(2-methylpropanoylamino)anilino]-4-oxobutanoate Traditional Name: 4-[4-(isobutyrylamino)anilino]-4-keto-butyric acid phenethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CCC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CCC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-16(2)22(27)24-19-10-8-18(9-11-19)23-20(25)12-13-21(26)28-15-14-17-6-4-3-5-7-17/h3-11,16H,12-15H2,1-2H3,(H,23,25)(H,24,27)