ethyl 2-[2-(6-nitro-1,3-benzodioxol-5-yl)benzimidazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-(6-nitro-1,3-benzodioxol-5-yl)benzimidazol-1-yl]ethanoate Openeye Name: ethyl 2-[2-(6-nitro-1,3-benzodioxol-5-yl)benzimidazol-1-yl]acetate CAS Name: 2-[2-(6-nitro-1,3-benzodioxol-5-yl)-1-benzimidazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(6-nitro-1,3-benzodioxol-5-yl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-(6-nitro-1,3-benzodioxol-5-yl)benzimidazol-1-yl]acetic acid ethyl ester Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2N=C1C3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2N=C1C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H15N3O6/c1-2-25-17(22)9-20-13-6-4-3-5-12(13)19-18(20)11-7-15-16(27-10-26-15)8-14(11)21(23)24/h3-8H,2,9-10H2,1H3