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

Systemtic Name: diethyl 3-(3-methoxyphenyl)-7-(3-nitrophenyl)carbonyl-pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Openeye Name: diethyl 3-(3-methoxyphenyl)-7-(3-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate CAS Name: 3-(3-methoxyphenyl)-7-[(3-nitrophenyl)-oxomethyl]pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-(3-methoxyphenyl)-7-(3-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate Traditional Name: 3-(3-methoxyphenyl)-7-(3-nitrobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid diethyl ester Formula: C27H23N3O8 MolecularWeight: 517.48682

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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)[N+](=O)[O-])C4=CC(=CC=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H23N3O8/c1-4-37-26(32)22-21-14-20(16-8-7-11-19(13-16)36-3)28-15-29(21)24(23(22)27(33)38-5-2)25(31)17-9-6-10-18(12-17)30(34)35/h6-15H,4-5H2,1-3H3