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

Systemtic Name: ethyl 2-[(3-bromophenyl)carbonylamino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-[(3-bromobenzoyl)amino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-1-cyclohexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-bromobenzoyl)amino]-1-cyclohexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-[(3-bromobenzoyl)amino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C26H25BrN4O3 MolecularWeight: 521.4057

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C5=CC(=CC=C5)Br

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C26H25BrN4O3/c1-2-34-26(33)21-22-24(29-20-14-7-6-13-19(20)28-22)31(18-11-4-3-5-12-18)23(21)30-25(32)16-9-8-10-17(27)15-16/h6-10,13-15,18H,2-5,11-12H2,1H3,(H,30,32)