(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(1-methyl-2-benzimidazolyl)-2-propenenitrile IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-(1-methylbenzimidazol-2-yl)acrylonitrile Formula: C18H12ClN3O2 MolecularWeight: 337.75978

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=CC3=CC4=C(C(=C3)Cl)OCO4)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1/C(=C/C3=CC4=C(C(=C3)Cl)OCO4)/C#N

InChI

InChI=1S/C18H12ClN3O2/c1-22-15-5-3-2-4-14(15)21-18(22)12(9-20)6-11-7-13(19)17-16(8-11)23-10-24-17/h2-8H,10H2,1H3/b12-6+