3-[1-[(E)-3-(5-chloranylcyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[(E)-3-(5-chloranylcyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[(E)-3-(5-chlorocyclohexa-1,5-dien-1-yl)prop-2-enoyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[(E)-3-(5-chloro-1-cyclohexa-1,5-dienyl)-1-oxoprop-2-enyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[(E)-3-(5-chlorocyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[(E)-3-(5-chlorocyclohexa-1,5-dien-1-yl)acryloyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=C1)C=CC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)Cl

Isomeric SMILES

C1CC(=CC(=C1)/C=C/C(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O)Cl

InChI

InChI=1S/C21H22ClN3O2/c22-16-5-3-4-15(14-16)8-9-20(26)24-12-10-17(11-13-24)25-19-7-2-1-6-18(19)23-21(25)27/h1-2,4,6-9,14,17H,3,5,10-13H2,(H,23,27)/b9-8+