(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid (6-methyl-2-imidazo[1,2-a]pyridinyl)methyl ester IUPAC Name: (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid (6-methylimidazo[1,2-a]pyridin-2-yl)methyl ester Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C=C(N=C2C=C1)COC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CC1=CN2C=C(N=C2C=C1)COC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C17H13N3O6/c1-10-2-3-16-18-11(7-19(16)6-10)8-24-17(21)12-4-14-15(26-9-25-14)5-13(12)20(22)23/h2-7H,8-9H2,1H3