3-but-1-ynyl-7-[4-(phenylmethyl)piperidin-1-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-but-1-ynyl-7-[4-(phenylmethyl)piperidin-1-yl]-1H-benzimidazol-2-one Openeye Name: 7-(4-benzyl-1-piperidyl)-3-but-1-ynyl-1H-benzimidazol-2-one CAS Name: 3-but-1-ynyl-7-[4-(phenylmethyl)-1-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 7-(4-benzylpiperidin-1-yl)-3-but-1-ynyl-1H-benzimidazol-2-one Traditional Name: 7-(4-benzylpiperidino)-3-but-1-ynyl-1H-benzimidazol-2-one Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CN1C2=C(C(=CC=C2)N3CCC(CC3)CC4=CC=CC=C4)NC1=O

Isomeric SMILES

CCC#CN1C2=C(C(=CC=C2)N3CCC(CC3)CC4=CC=CC=C4)NC1=O

InChI

InChI=1S/C23H25N3O/c1-2-3-14-26-21-11-7-10-20(22(21)24-23(26)27)25-15-12-19(13-16-25)17-18-8-5-4-6-9-18/h4-11,19H,2,12-13,15-17H2,1H3,(H,24,27)