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

Systemtic Name: [1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate Openeye Name: 1-[(2,4-dichlorophenyl)carbamoyl]propyl 2,3-diphenylquinoxaline-6-carboxylate CAS Name: 2,3-diphenyl-6-quinoxalinecarboxylic acid [1-(2,4-dichloroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,4-dichloroanilino)-1-oxobutan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate Traditional Name: 2,3-diphenylquinoxaline-6-carboxylic acid 1-[(2,4-dichlorophenyl)carbamoyl]propyl ester Formula: C31H23Cl2N3O3 MolecularWeight: 556.43862

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C31H23Cl2N3O3/c1-2-27(30(37)36-24-16-14-22(32)18-23(24)33)39-31(38)21-13-15-25-26(17-21)35-29(20-11-7-4-8-12-20)28(34-25)19-9-5-3-6-10-19/h3-18,27H,2H2,1H3,(H,36,37)