methyl 4-[2-[3-(2-acetamidophenyl)-2-oxidanylidene-quinoxalin-1-yl]butanoylamino]benzoate

Systemtic Name: methyl 4-[2-[3-(2-acetamidophenyl)-2-oxidanylidene-quinoxalin-1-yl]butanoylamino]benzoate Openeye Name: methyl 4-[2-[3-(2-acetamidophenyl)-2-oxo-quinoxalin-1-yl]butanoylamino]benzoate CAS Name: 4-[[2-[3-(2-acetamidophenyl)-2-oxo-1-quinoxalinyl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[3-(2-acetamidophenyl)-2-oxoquinoxalin-1-yl]butanoylamino]benzoate Traditional Name: 4-[2-[3-(2-acetamidophenyl)-2-keto-quinoxalin-1-yl]butanoylamino]benzoic acid methyl ester Formula: C28H26N4O5 MolecularWeight: 498.52984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)N2C3=CC=CC=C3N=C(C2=O)C4=CC=CC=C4NC(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)N2C3=CC=CC=C3N=C(C2=O)C4=CC=CC=C4NC(=O)C

InChI

InChI=1S/C28H26N4O5/c1-4-23(26(34)30-19-15-13-18(14-16-19)28(36)37-3)32-24-12-8-7-11-22(24)31-25(27(32)35)20-9-5-6-10-21(20)29-17(2)33/h5-16,23H,4H2,1-3H3,(H,29,33)(H,30,34)