2-(2-azidoethoxymethyl)-4-(3-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2-(2-azidoethoxymethyl)-4-(3-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2-(2-azidoethoxymethyl)-4-(3-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2-(2-azidoethoxymethyl)-4-(3-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2-(2-azidoethoxymethyl)-4-(3-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2-(2-azidoethoxymethyl)-4-(3-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H17ClN4O5 MolecularWeight: 392.79368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN4O5/c1-9-13(16(23)24)14(10-3-2-4-11(18)7-10)15(17(25)26)12(21-9)8-27-6-5-20-22-19/h2-4,7,14,21H,5-6,8H2,1H3,(H,23,24)(H,25,26)