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

Systemtic Name: 2-(2-azidoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-5-(methylperoxymethyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-(2-azidoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-5-(methylperoxymethyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2-(2-azidoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-5-(methyldioxymethyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-(2-azidoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-5-(methylperoxymethyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-(2-azidoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-5-(methylperoxymethyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C18H21ClN4O5 MolecularWeight: 408.83614

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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=C2Cl)COOC

Isomeric SMILES

CC1=C(C(C(=C(N1)COCCN=[N+]=[N-])C(=O)O)C2=CC=CC=C2Cl)COOC

InChI

InChI=1S/C18H21ClN4O5/c1-11-13(9-28-26-2)16(12-5-3-4-6-14(12)19)17(18(24)25)15(22-11)10-27-8-7-21-23-20/h3-6,16,22H,7-10H2,1-2H3,(H,24,25)