1-methoxypropan-2-yl 2-azanyl-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: 1-methoxypropan-2-yl 2-azanyl-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: (2-methoxy-1-methyl-ethyl) 2-amino-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(4-bromophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 1-methoxypropan-2-yl ester IUPAC Name: 1-methoxypropan-2-yl 2-amino-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid (2-methoxy-1-methyl-ethyl) ester Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)Br)N

Isomeric SMILES

CC(COC)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)Br)N

InChI

InChI=1S/C21H19BrN4O3/c1-12(11-28-2)29-21(27)17-18-20(25-16-6-4-3-5-15(16)24-18)26(19(17)23)14-9-7-13(22)8-10-14/h3-10,12H,11,23H2,1-2H3