(2S)-2-[4-(4-azanylbutyl)-1,2,3-triazol-1-yl]-3-oxidanyl-1-piperidin-4-yl-butan-1-one

Systemtic Name: (2S)-2-[4-(4-azanylbutyl)-1,2,3-triazol-1-yl]-3-oxidanyl-1-piperidin-4-yl-butan-1-one Openeye Name: (2S)-2-[4-(4-aminobutyl)triazol-1-yl]-3-hydroxy-1-(4-piperidyl)butan-1-one CAS Name: (2S)-2-[4-(4-aminobutyl)-1-triazolyl]-3-hydroxy-1-(4-piperidinyl)-1-butanone IUPAC Name: (2S)-2-[4-(4-aminobutyl)triazol-1-yl]-3-hydroxy-1-piperidin-4-ylbutan-1-one Traditional Name: (2S)-2-[4-(4-aminobutyl)triazol-1-yl]-3-hydroxy-1-(4-piperidyl)butan-1-one Formula: C15H27N5O2 MolecularWeight: 309.40718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)C1CCNCC1)N2C=C(N=N2)CCCCN)O

Isomeric SMILES

CC([C@@H](C(=O)C1CCNCC1)N2C=C(N=N2)CCCCN)O

InChI

InChI=1S/C15H27N5O2/c1-11(21)14(15(22)12-5-8-17-9-6-12)20-10-13(18-19-20)4-2-3-7-16/h10-12,14,17,21H,2-9,16H2,1H3/t11?,14-/m0/s1