[1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate

Systemtic Name: [1-[(5-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate Openeye Name: 1-[(5-chloro-2-methyl-phenyl)carbamoyl]propyl 2,3-diphenylquinoxaline-6-carboxylate CAS Name: 2,3-diphenyl-6-quinoxalinecarboxylic acid [1-(5-chloro-2-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(5-chloro-2-methylanilino)-1-oxobutan-2-yl] 2,3-diphenylquinoxaline-6-carboxylate Traditional Name: 2,3-diphenylquinoxaline-6-carboxylic acid 1-[(5-chloro-2-methyl-phenyl)carbamoyl]propyl ester Formula: C32H26ClN3O3 MolecularWeight: 536.02014

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C32H26ClN3O3/c1-3-28(31(37)36-26-19-24(33)16-14-20(26)2)39-32(38)23-15-17-25-27(18-23)35-30(22-12-8-5-9-13-22)29(34-25)21-10-6-4-7-11-21/h4-19,28H,3H2,1-2H3,(H,36,37)