2-[(2-hydroxyethylamino)methyl]-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: 2-[(2-hydroxyethylamino)methyl]-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: 2-[(2-hydroxyethylamino)methyl]-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[(2-hydroxyethylamino)methyl]-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate IUPAC Name: 2-[(2-hydroxyethylamino)methyl]-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(2-hydroxyethylamino)methyl]-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Formula: C17H17N3O7-2 MolecularWeight: 375.33278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CNCCO)C(=O)[O-])C2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)CNCCO)C(=O)[O-])C2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H19N3O7/c1-9-13(16(22)23)14(10-4-2-3-5-12(10)20(26)27)15(17(24)25)11(19-9)8-18-6-7-21/h2-5,14,18-19,21H,6-8H2,1H3,(H,22,23)(H,24,25)/p-2