ethyl 4-[[2-(3-methylbutylamino)-2-oxidanylidene-ethanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(3-methylbutylamino)-2-oxidanylidene-ethanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-(isopentylamino)-2-oxo-acetyl]amino]benzoate CAS Name: 4-[[2-(3-methylbutylamino)-1,2-dioxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-methylbutylamino)-2-oxoacetyl]amino]benzoate Traditional Name: 4-[[2-(isoamylamino)-2-keto-acetyl]amino]benzoic acid ethyl ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCCC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCCC(C)C

InChI

InChI=1S/C16H22N2O4/c1-4-22-16(21)12-5-7-13(8-6-12)18-15(20)14(19)17-10-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,17,19)(H,18,20)