2-(2-azidoethoxymethyl)-4-(2-chlorophenyl)-5-methoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=C(C1C2=CC=CC=C2Cl)C(=O)O)COCCN=[N+]=[N-]

Isomeric SMILES

COC(=O)C1=CNC(=C(C1C2=CC=CC=C2Cl)C(=O)O)COCCN=[N+]=[N-]

InChI

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