4-piperidin-4-yl-1-[(1-propylcyclooctyl)methyl]-3-prop-2-ynyl-benzimidazol-2-one

Systemtic Name: 4-piperidin-4-yl-1-[(1-propylcyclooctyl)methyl]-3-prop-2-ynyl-benzimidazol-2-one Openeye Name: 4-(4-piperidyl)-1-[(1-propylcyclooctyl)methyl]-3-prop-2-ynyl-benzimidazol-2-one CAS Name: 4-(4-piperidinyl)-1-[(1-propylcyclooctyl)methyl]-3-prop-2-ynyl-2-benzimidazolone IUPAC Name: 4-piperidin-4-yl-1-[(1-propylcyclooctyl)methyl]-3-prop-2-ynylbenzimidazol-2-one Traditional Name: 4-(4-piperidyl)-3-propargyl-1-[(1-propylcyclooctyl)methyl]benzimidazol-2-one Formula: C27H39N3O MolecularWeight: 421.61806

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCCCC1)CN2C3=CC=CC(=C3N(C2=O)CC#C)C4CCNCC4

Isomeric SMILES

CCCC1(CCCCCCC1)CN2C3=CC=CC(=C3N(C2=O)CC#C)C4CCNCC4

InChI

InChI=1S/C27H39N3O/c1-3-15-27(16-8-6-5-7-9-17-27)21-30-24-12-10-11-23(22-13-18-28-19-14-22)25(24)29(20-4-2)26(30)31/h2,10-12,22,28H,3,5-9,13-21H2,1H3