ethyl 3-(3-bromophenyl)-7-(4-nitrophenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(3-bromophenyl)-7-(4-nitrophenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5-carboxylate Openeye Name: ethyl 3-(3-bromophenyl)-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate CAS Name: 3-(3-bromophenyl)-7-[(4-nitrophenyl)-oxomethyl]-5-pyrrolo[1,2-c]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-bromophenyl)-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate Traditional Name: 3-(3-bromophenyl)-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5-carboxylic acid ethyl ester Formula: C23H16BrN3O5 MolecularWeight: 494.29424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H16BrN3O5/c1-2-32-23(29)18-11-21(22(28)14-6-8-17(9-7-14)27(30)31)26-13-25-19(12-20(18)26)15-4-3-5-16(24)10-15/h3-13H,2H2,1H3