ethyl 2-azanyl-4-(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 2-amino-4-(4-benzyloxy-5-methoxy-2-nitro-phenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 2-amino-4-(5-methoxy-2-nitro-4-phenylmethoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(5-methoxy-2-nitro-4-phenylmethoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 2-amino-4-(4-benzoxy-5-methoxy-2-nitro-phenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=CC(=C(C=C2[N+](=O)[O-])OCC3=CC=CC=C3)OC)N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=CC(=C(C=C2[N+](=O)[O-])OCC3=CC=CC=C3)OC)N)C

InChI

InChI=1S/C22H24N4O6/c1-4-31-21(27)19-13(2)24-22(23)25-20(19)15-10-17(30-3)18(11-16(15)26(28)29)32-12-14-8-6-5-7-9-14/h5-11,20H,4,12H2,1-3H3,(H3,23,24,25)