methyl 2-(4-bromophenyl)-3-cyano-1-(3-nitrophenyl)carbonyl-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate

Systemtic Name: methyl 2-(4-bromophenyl)-3-cyano-1-(3-nitrophenyl)carbonyl-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate Openeye Name: methyl 2-(4-bromophenyl)-3-cyano-1-(3-nitrobenzoyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate CAS Name: 2-(4-bromophenyl)-3-cyano-1-[(3-nitrophenyl)-oxomethyl]-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-3-cyano-1-(3-nitrobenzoyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate Traditional Name: 2-(4-bromophenyl)-3-cyano-1-(3-nitrobenzoyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylic acid methyl ester Formula: C28H20BrN3O5 MolecularWeight: 558.3795

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C2C=CC3=CC=CC=C3N2C(C1C4=CC=C(C=C4)Br)C(=O)C5=CC(=CC=C5)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)C1(C2C=CC3=CC=CC=C3N2C(C1C4=CC=C(C=C4)Br)C(=O)C5=CC(=CC=C5)[N+](=O)[O-])C#N

InChI

InChI=1S/C28H20BrN3O5/c1-37-27(34)28(16-30)23-14-11-17-5-2-3-8-22(17)31(23)25(24(28)18-9-12-20(29)13-10-18)26(33)19-6-4-7-21(15-19)32(35)36/h2-15,23-25H,1H3