6-[3-[4-(phenylmethyl)piperidin-1-yl]prop-1-ynyl]-3H-1,3-benzoxazol-2-one

Systemtic Name: 6-[3-[4-(phenylmethyl)piperidin-1-yl]prop-1-ynyl]-3H-1,3-benzoxazol-2-one Openeye Name: 6-[3-(4-benzyl-1-piperidyl)prop-1-ynyl]-3H-1,3-benzoxazol-2-one CAS Name: 6-[3-[4-(phenylmethyl)-1-piperidinyl]prop-1-ynyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-[3-(4-benzylpiperidin-1-yl)prop-1-ynyl]-3H-1,3-benzoxazol-2-one Traditional Name: 6-[3-(4-benzylpiperidino)prop-1-ynyl]-3H-1,3-benzoxazol-2-one Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC#CC3=CC4=C(C=C3)NC(=O)O4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC#CC3=CC4=C(C=C3)NC(=O)O4

InChI

InChI=1S/C22H22N2O2/c25-22-23-20-9-8-18(16-21(20)26-22)7-4-12-24-13-10-19(11-14-24)15-17-5-2-1-3-6-17/h1-3,5-6,8-9,16,19H,10-15H2,(H,23,25)