6-azanyl-4-(2-chloranyl-5-nitro-phenyl)-2-ethoxy-3,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 6-azanyl-4-(2-chloranyl-5-nitro-phenyl)-2-ethoxy-3,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 6-amino-4-(2-chloro-5-nitro-phenyl)-2-ethoxy-3,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 6-amino-4-(2-chloro-5-nitrophenyl)-2-ethoxy-3,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 6-amino-4-(2-chloro-5-nitrophenyl)-2-ethoxy-3,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 6-amino-4-(2-chloro-5-nitro-phenyl)-2-ethoxy-3,4-dihydropyridine-3,5-dicarboxylic acid Formula: C15H14ClN3O7 MolecularWeight: 383.74056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=C(C(C1C(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O)N

Isomeric SMILES

CCOC1=NC(=C(C(C1C(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)O)N

InChI

InChI=1S/C15H14ClN3O7/c1-2-26-13-11(15(22)23)9(10(14(20)21)12(17)18-13)7-5-6(19(24)25)3-4-8(7)16/h3-5,9,11H,2,17H2,1H3,(H,20,21)(H,22,23)