4-(3-chlorophenyl)-6-methyl-3-(4-nitrophenoxy)carbonyl-2,4-dihydropyrimidine-1-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-6-methyl-3-(4-nitrophenoxy)carbonyl-2,4-dihydropyrimidine-1-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-6-methyl-3-(4-nitrophenoxy)carbonyl-2,4-dihydropyrimidine-1-carboxylic acid CAS Name: 4-(3-chlorophenyl)-6-methyl-3-[(4-nitrophenoxy)-oxomethyl]-2,4-dihydropyrimidine-1-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-6-methyl-3-(4-nitrophenoxy)carbonyl-2,4-dihydropyrimidine-1-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-6-methyl-3-(4-nitrophenoxy)carbonyl-2,4-dihydropyrimidine-1-carboxylic acid Formula: C19H16ClN3O6 MolecularWeight: 417.79984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(CN1C(=O)O)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(N(CN1C(=O)O)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H16ClN3O6/c1-12-9-17(13-3-2-4-14(20)10-13)22(11-21(12)18(24)25)19(26)29-16-7-5-15(6-8-16)23(27)28/h2-10,17H,11H2,1H3,(H,24,25)