ethyl 4-(2,1,3-benzoxadiazol-4-yl)-2-(chloromethyl)-6-methyl-5-nitro-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 4-(2,1,3-benzoxadiazol-4-yl)-2-(chloromethyl)-6-methyl-5-nitro-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 4-(2,1,3-benzoxadiazol-4-yl)-2-(chloromethyl)-6-methyl-5-nitro-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2,1,3-benzoxadiazol-4-yl)-2-(chloromethyl)-6-methyl-5-nitro-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,1,3-benzoxadiazol-4-yl)-2-(chloromethyl)-6-methyl-5-nitro-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-benzofurazan-4-yl-2-(chloromethyl)-6-methyl-5-nitro-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C16H15ClN4O5 MolecularWeight: 378.7671

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=NON=C32)[N+](=O)[O-])C)CCl

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=NON=C32)[N+](=O)[O-])C)CCl

InChI

InChI=1S/C16H15ClN4O5/c1-3-25-16(22)13-11(7-17)18-8(2)15(21(23)24)12(13)9-5-4-6-10-14(9)20-26-19-10/h4-6,12,18H,3,7H2,1-2H3