[1-[(4-acetamidophenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate

Systemtic Name: [1-[(4-acetamidophenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate Openeye Name: 1-[(4-acetamidophenyl)carbamoyl]propyl 2,3-diphenylquinoxaline-6-carboxylate CAS Name: 2,3-diphenyl-6-quinoxalinecarboxylic acid [1-(4-acetamidoanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-acetamidoanilino)-1-oxobutan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate Traditional Name: 2,3-diphenylquinoxaline-6-carboxylic acid 1-[(4-acetamidophenyl)carbamoyl]propyl ester Formula: C33H28N4O4 MolecularWeight: 544.59982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H28N4O4/c1-3-29(32(39)35-26-17-15-25(16-18-26)34-21(2)38)41-33(40)24-14-19-27-28(20-24)37-31(23-12-8-5-9-13-23)30(36-27)22-10-6-4-7-11-22/h4-20,29H,3H2,1-2H3,(H,34,38)(H,35,39)