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

Systemtic Name: ethyl 2-[(3-bromophenyl)carbonylamino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-[(3-bromobenzoyl)amino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-1-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-bromobenzoyl)amino]-1-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-[(3-bromobenzoyl)amino]-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C28H23BrN4O3 MolecularWeight: 543.41122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H23BrN4O3/c1-2-36-28(35)23-24-26(31-22-14-7-6-13-21(22)30-24)33(16-15-18-9-4-3-5-10-18)25(23)32-27(34)19-11-8-12-20(29)17-19/h3-14,17H,2,15-16H2,1H3,(H,32,34)