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

Systemtic Name: pentyl 2-[(3-bromophenyl)carbonylamino]-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: pentyl 2-[(3-bromobenzoyl)amino]-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-1-(2-methoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid pentyl ester IUPAC Name: pentyl 2-[(3-bromobenzoyl)amino]-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-[(3-bromobenzoyl)amino]-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid amyl ester Formula: C30H27BrN4O4 MolecularWeight: 587.46378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC=C4OC)NC(=O)C5=CC(=CC=C5)Br

Isomeric SMILES

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC=C4OC)NC(=O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C30H27BrN4O4/c1-3-4-9-17-39-30(37)25-26-28(33-22-14-6-5-13-21(22)32-26)35(23-15-7-8-16-24(23)38-2)27(25)34-29(36)19-11-10-12-20(31)18-19/h5-8,10-16,18H,3-4,9,17H2,1-2H3,(H,34,36)