butyl 2-[(2-chlorophenyl)carbonylamino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: butyl 2-[(2-chlorophenyl)carbonylamino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: butyl 2-[(2-chlorobenzoyl)amino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-1-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butyl ester IUPAC Name: butyl 2-[(2-chlorobenzoyl)amino]-1-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-[(2-chlorobenzoyl)amino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid butyl ester Formula: C30H27ClN4O3 MolecularWeight: 527.01338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C30H27ClN4O3/c1-2-3-19-38-30(37)25-26-28(33-24-16-10-9-15-23(24)32-26)35(18-17-20-11-5-4-6-12-20)27(25)34-29(36)21-13-7-8-14-22(21)31/h4-16H,2-3,17-19H2,1H3,(H,34,36)