methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylate hydrochloride

Systemtic Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylate hydrochloride Openeye Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylate hydrochloride CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylate hydrochloride Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester hydrochloride Formula: C14H16ClN3O4 MolecularWeight: 325.74754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC.Cl

Isomeric SMILES

CC1=C(C(N=C(N1)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC.Cl

InChI

InChI=1S/C14H15N3O4.ClH/c1-8-12(14(18)21-3)13(16-9(2)15-8)10-5-4-6-11(7-10)17(19)20;/h4-7,13H,1-3H3,(H,15,16);1H