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

Systemtic Name: ethyl 7-(4-nitrophenyl)carbonyl-3-(4-phenylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate Openeye Name: ethyl 7-(4-nitrobenzoyl)-3-(4-phenylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate CAS Name: 7-[(4-nitrophenyl)-oxomethyl]-3-(4-phenylphenyl)-5-pyrrolo[1,2-c]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-nitrobenzoyl)-3-(4-phenylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate Traditional Name: 7-(4-nitrobenzoyl)-3-(4-phenylphenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylic acid ethyl ester Formula: C29H21N3O5 MolecularWeight: 491.49414

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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=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H21N3O5/c1-2-37-29(34)24-16-27(28(33)22-12-14-23(15-13-22)32(35)36)31-18-30-25(17-26(24)31)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h3-18H,2H2,1H3