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

Systemtic Name: 4-(3-nitrophenyl)-2,6-bis(pyridin-3-yloxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(3-nitrophenyl)-2,6-bis(3-pyridyloxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(3-nitrophenyl)-2,6-bis(3-pyridinyloxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(3-nitrophenyl)-2,6-bis(pyridin-3-yloxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(3-nitrophenyl)-2,6-bis(3-pyridyloxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C25H20N4O8 MolecularWeight: 504.4483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(=C(NC(=C2C(=O)O)COC3=CN=CC=C3)COC4=CN=CC=C4)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(=C(NC(=C2C(=O)O)COC3=CN=CC=C3)COC4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C25H20N4O8/c30-24(31)22-19(13-36-17-6-2-8-26-11-17)28-20(14-37-18-7-3-9-27-12-18)23(25(32)33)21(22)15-4-1-5-16(10-15)29(34)35/h1-12,21,28H,13-14H2,(H,30,31)(H,32,33)