(2S,3R)-3-(4-methylidenepiperidin-1-yl)-2-phenyl-1-(1,2,4-triazol-1-yl)butan-2-ol

Systemtic Name: (2S,3R)-3-(4-methylidenepiperidin-1-yl)-2-phenyl-1-(1,2,4-triazol-1-yl)butan-2-ol Openeye Name: (2S,3R)-3-(4-methylene-1-piperidyl)-2-phenyl-1-(1,2,4-triazol-1-yl)butan-2-ol CAS Name: (2S,3R)-3-(4-methylene-1-piperidinyl)-2-phenyl-1-(1,2,4-triazol-1-yl)-2-butanol IUPAC Name: (2S,3R)-3-(4-methylidenepiperidin-1-yl)-2-phenyl-1-(1,2,4-triazol-1-yl)butan-2-ol Traditional Name: (2S,3R)-3-(4-methylenepiperidino)-2-phenyl-1-(1,2,4-triazol-1-yl)butan-2-ol Formula: C18H24N4O MolecularWeight: 312.40936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=CC=CC=C2)O)N3CCC(=C)CC3

Isomeric SMILES

C[C@H]([C@@](CN1C=NC=N1)(C2=CC=CC=C2)O)N3CCC(=C)CC3

InChI

InChI=1S/C18H24N4O/c1-15-8-10-21(11-9-15)16(2)18(23,12-22-14-19-13-20-22)17-6-4-3-5-7-17/h3-7,13-14,16,23H,1,8-12H2,2H3/t16-,18+/m1/s1