ethyl 1-(3-bromanyl-4-methoxy-phenyl)carbonyl-3-cyano-2-(4-nitrophenyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate

Systemtic Name: ethyl 1-(3-bromanyl-4-methoxy-phenyl)carbonyl-3-cyano-2-(4-nitrophenyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate Openeye Name: ethyl 1-(3-bromo-4-methoxy-benzoyl)-3-cyano-2-(4-nitrophenyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate CAS Name: 1-[(3-bromo-4-methoxyphenyl)-oxomethyl]-3-cyano-2-(4-nitrophenyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromo-4-methoxybenzoyl)-3-cyano-2-(4-nitrophenyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylate Traditional Name: 1-(3-bromo-4-methoxy-benzoyl)-3-cyano-2-(4-nitrophenyl)-2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3-carboxylic acid ethyl ester Formula: C30H24BrN3O6 MolecularWeight: 602.43206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H24BrN3O6/c1-3-40-29(36)30(17-32)25-15-11-18-6-4-5-7-23(18)33(25)27(26(30)19-8-12-21(13-9-19)34(37)38)28(35)20-10-14-24(39-2)22(31)16-20/h4-16,25-27H,3H2,1-2H3