2,6-bis(ethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-bis(ethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2,6-bis(ethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2,6-bis(ethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-bis(ethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2,6-bis(ethoxymethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C19H22N2O8 MolecularWeight: 406.38658

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C(C(=C(N1)COCC)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCOCC1=C(C(C(=C(N1)COCC)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C19H22N2O8/c1-3-28-9-13-16(18(22)23)15(11-6-5-7-12(8-11)21(26)27)17(19(24)25)14(20-13)10-29-4-2/h5-8,15,20H,3-4,9-10H2,1-2H3,(H,22,23)(H,24,25)