5-[[4-phenyl-4-[(3-propan-2-yloxyphenyl)methoxymethyl]piperidin-1-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one

Systemtic Name: 5-[[4-phenyl-4-[(3-propan-2-yloxyphenyl)methoxymethyl]piperidin-1-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one Openeye Name: 5-[[4-[(3-isopropoxyphenyl)methoxymethyl]-4-phenyl-1-piperidyl]methyl]-1,2-dihydro-1,2,4-triazol-3-one CAS Name: 5-[[4-phenyl-4-[(3-propan-2-yloxyphenyl)methoxymethyl]-1-piperidinyl]methyl]-1,2-dihydro-1,2,4-triazol-3-one IUPAC Name: 5-[[4-phenyl-4-[(3-propan-2-yloxyphenyl)methoxymethyl]piperidin-1-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one Traditional Name: 5-[[4-[(3-isopropoxybenzyl)oxymethyl]-4-phenyl-piperidino]methyl]-1,2-dihydro-1,2,4-triazol-3-one Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)COCC2(CCN(CC2)CC3=NC(=O)NN3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)COCC2(CCN(CC2)CC3=NC(=O)NN3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4O3/c1-19(2)32-22-10-6-7-20(15-22)17-31-18-25(21-8-4-3-5-9-21)11-13-29(14-12-25)16-23-26-24(30)28-27-23/h3-10,15,19H,11-14,16-18H2,1-2H3,(H2,26,27,28,30)