ethyl 2-[(3-bromophenyl)carbonylamino]-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-[(3-bromophenyl)carbonylamino]-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 1-benzyl-2-[(3-bromobenzoyl)amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-1-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-[(3-bromobenzoyl)amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-benzyl-2-[(3-bromobenzoyl)amino]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C27H21BrN4O3 MolecularWeight: 529.38464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)NC(=O)C5=CC(=CC=C5)Br

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)NC(=O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C27H21BrN4O3/c1-2-35-27(34)22-23-25(30-21-14-7-6-13-20(21)29-23)32(16-17-9-4-3-5-10-17)24(22)31-26(33)18-11-8-12-19(28)15-18/h3-15H,2,16H2,1H3,(H,31,33)