(E)-4-(2-methylbenzimidazol-1-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2-methylbenzimidazol-1-yl)but-3-en-2-one Openeye Name: (E)-4-(2-methylbenzimidazol-1-yl)but-3-en-2-one CAS Name: (E)-4-(2-methyl-1-benzimidazolyl)-3-buten-2-one IUPAC Name: (E)-4-(2-methylbenzimidazol-1-yl)but-3-en-2-one Traditional Name: (E)-4-(2-methylbenzimidazol-1-yl)but-3-en-2-one Formula: C12H12N2O MolecularWeight: 200.23648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1C=CC(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N1/C=C/C(=O)C

InChI

InChI=1S/C12H12N2O/c1-9(15)7-8-14-10(2)13-11-5-3-4-6-12(11)14/h3-8H,1-2H3/b8-7+