dimethyl 7-(2-nitrophenyl)carbonyl-3-phenyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate

Systemtic Name: dimethyl 7-(2-nitrophenyl)carbonyl-3-phenyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Openeye Name: dimethyl 7-(2-nitrobenzoyl)-3-phenyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate CAS Name: 7-[(2-nitrophenyl)-oxomethyl]-3-phenylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-(2-nitrobenzoyl)-3-phenylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Traditional Name: 7-(2-nitrobenzoyl)-3-phenyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester Formula: C24H17N3O7 MolecularWeight: 459.40768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OC)C(=O)C3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OC)C(=O)C3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H17N3O7/c1-33-23(29)19-18-12-16(14-8-4-3-5-9-14)25-13-26(18)21(20(19)24(30)34-2)22(28)15-10-6-7-11-17(15)27(31)32/h3-13H,1-2H3