2-azanyl-5-ethoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-azanyl-5-ethoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-amino-5-ethoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2-amino-5-ethoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate IUPAC Name: 2-amino-5-ethoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 2-amino-5-carbethoxy-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Formula: C16H16N3O6- MolecularWeight: 346.31474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)[O-])N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)[O-])N)C

InChI

InChI=1S/C16H17N3O6/c1-3-25-16(22)11-8(2)18-14(17)13(15(20)21)12(11)9-5-4-6-10(7-9)19(23)24/h4-7,12,18H,3,17H2,1-2H3,(H,20,21)/p-1