3-[1-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N3O4/c25-18(14-5-6-19-20(11-14)28-13-27-19)12-23-9-7-15(8-10-23)24-17-4-2-1-3-16(17)22-21(24)26/h1-6,11,15H,7-10,12-13H2,(H,22,26)