diethyl 3-(4-methylphenyl)-7-(phenylcarbonyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate

Systemtic Name: diethyl 3-(4-methylphenyl)-7-(phenylcarbonyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Openeye Name: diethyl 7-benzoyl-3-(p-tolyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate CAS Name: 7-benzoyl-3-(4-methylphenyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 7-benzoyl-3-(4-methylphenyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Traditional Name: 7-benzoyl-3-(p-tolyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid diethyl ester Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OCC)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OCC)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H24N2O5/c1-4-33-26(31)22-21-15-20(18-13-11-17(3)12-14-18)28-16-29(21)24(23(22)27(32)34-5-2)25(30)19-9-7-6-8-10-19/h6-16H,4-5H2,1-3H3