dimethyl 3-methyl-7-(4-nitrophenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate

Systemtic Name: dimethyl 3-methyl-7-(4-nitrophenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Openeye Name: dimethyl 3-methyl-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate CAS Name: 3-methyl-7-[(4-nitrophenyl)-oxomethyl]pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Traditional Name: 3-methyl-7-(4-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid dimethyl ester Formula: C19H15N3O7 MolecularWeight: 397.3383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N2C=N1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C(=C(N2C=N1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H15N3O7/c1-10-8-13-14(18(24)28-2)15(19(25)29-3)16(21(13)9-20-10)17(23)11-4-6-12(7-5-11)22(26)27/h4-9H,1-3H3