2-(2-azidoethoxymethyl)-4-(1,3-benzodioxol-5-yl)-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-(2-azidoethoxymethyl)-4-(1,3-benzodioxol-5-yl)-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-acetyl-2-(2-azidoethoxymethyl)-4-(1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-acetyl-2-(2-azidoethoxymethyl)-4-(1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-acetyl-2-(2-azidoethoxymethyl)-4-(1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-acetyl-2-(2-azidoethoxymethyl)-4-(1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid Formula: C19H20N4O6 MolecularWeight: 400.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)COCCN=[N+]=[N-])C(=O)O)C2=CC3=C(C=C2)OCO3)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)COCCN=[N+]=[N-])C(=O)O)C2=CC3=C(C=C2)OCO3)C(=O)C

InChI

InChI=1S/C19H20N4O6/c1-10-16(11(2)24)17(12-3-4-14-15(7-12)29-9-28-14)18(19(25)26)13(22-10)8-27-6-5-21-23-20/h3-4,7,17,22H,5-6,8-9H2,1-2H3,(H,25,26)