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

Systemtic Name: ethyl 2-[(3-bromophenyl)carbonylamino]-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-[(3-bromobenzoyl)amino]-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-1-pentyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-bromobenzoyl)amino]-1-pentylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-amyl-2-[(3-bromobenzoyl)amino]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C25H25BrN4O3 MolecularWeight: 509.395

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C25H25BrN4O3/c1-3-5-8-14-30-22(29-24(31)16-10-9-11-17(26)15-16)20(25(32)33-4-2)21-23(30)28-19-13-7-6-12-18(19)27-21/h6-7,9-13,15H,3-5,8,14H2,1-2H3,(H,29,31)