(E)-2-methoxy-1-[4-(6-methylbenzimidazol-1-yl)piperidin-1-yl]but-2-en-1-one

Systemtic Name: (E)-2-methoxy-1-[4-(6-methylbenzimidazol-1-yl)piperidin-1-yl]but-2-en-1-one Openeye Name: (E)-2-methoxy-1-[4-(6-methylbenzimidazol-1-yl)-1-piperidyl]but-2-en-1-one CAS Name: (E)-2-methoxy-1-[4-(6-methyl-1-benzimidazolyl)-1-piperidinyl]-2-buten-1-one IUPAC Name: (E)-2-methoxy-1-[4-(6-methylbenzimidazol-1-yl)piperidin-1-yl]but-2-en-1-one Traditional Name: (E)-2-methoxy-1-[4-(6-methylbenzimidazol-1-yl)piperidino]but-2-en-1-one Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(=O)N1CCC(CC1)N2C=NC3=C2C=C(C=C3)C)OC

Isomeric SMILES

C/C=C(\C(=O)N1CCC(CC1)N2C=NC3=C2C=C(C=C3)C)/OC

InChI

InChI=1S/C18H23N3O2/c1-4-17(23-3)18(22)20-9-7-14(8-10-20)21-12-19-15-6-5-13(2)11-16(15)21/h4-6,11-12,14H,7-10H2,1-3H3/b17-4+