[5-azanyl-1,6-dimethyl-4,7-bis(oxidanyl)benzimidazol-2-yl]methyl ethanoate

Systemtic Name: [5-azanyl-1,6-dimethyl-4,7-bis(oxidanyl)benzimidazol-2-yl]methyl ethanoate Openeye Name: (5-amino-4,7-dihydroxy-1,6-dimethyl-benzimidazol-2-yl)methyl acetate CAS Name: acetic acid (5-amino-4,7-dihydroxy-1,6-dimethyl-2-benzimidazolyl)methyl ester IUPAC Name: (5-amino-4,7-dihydroxy-1,6-dimethylbenzimidazol-2-yl)methyl acetate Traditional Name: acetic acid (5-amino-4,7-dihydroxy-1,6-dimethyl-benzimidazol-2-yl)methyl ester Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1O)N(C(=N2)COC(=O)C)C)O)N

Isomeric SMILES

CC1=C(C(=C2C(=C1O)N(C(=N2)COC(=O)C)C)O)N

InChI

InChI=1S/C12H15N3O4/c1-5-8(13)12(18)9-10(11(5)17)15(3)7(14-9)4-19-6(2)16/h17-18H,4,13H2,1-3H3