cyclopentyl 4-methyl-6-(4-nitrophenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: cyclopentyl 4-methyl-6-(4-nitrophenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: cyclopentyl 3-allyl-4-methyl-6-(4-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-6-(4-nitrophenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl 4-methyl-6-(4-nitrophenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-2-keto-4-methyl-6-(4-nitrophenyl)-1,6-dihydropyrimidine-5-carboxylic acid cyclopentyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC=C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC3CCCC3

Isomeric SMILES

CC1=C(C(NC(=O)N1CC=C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC3CCCC3

InChI

InChI=1S/C20H23N3O5/c1-3-12-22-13(2)17(19(24)28-16-6-4-5-7-16)18(21-20(22)25)14-8-10-15(11-9-14)23(26)27/h3,8-11,16,18H,1,4-7,12H2,2H3,(H,21,25)