[(3S)-2-methylhexan-3-yl]-[[(3R)-1-(2-methylpropanoyl)piperidin-3-yl]methyl]azanium

Systemtic Name: [(3S)-2-methylhexan-3-yl]-[[(3R)-1-(2-methylpropanoyl)piperidin-3-yl]methyl]azanium Openeye Name: [(1S)-1-isopropylbutyl]-[[(3R)-1-(2-methylpropanoyl)-3-piperidyl]methyl]ammonium CAS Name: [(3S)-2-methylhexan-3-yl]-[[(3R)-1-(2-methyl-1-oxopropyl)-3-piperidinyl]methyl]ammonium IUPAC Name: [(3S)-2-methylhexan-3-yl]-[[(3R)-1-(2-methylpropanoyl)piperidin-3-yl]methyl]azanium Traditional Name: [(3R)-1-isobutyryl-3-piperidyl]methyl-[(1S)-1-isopropylbutyl]ammonium Formula: C17H35N2O+ MolecularWeight: 283.4726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)C)[NH2+]CC1CCCN(C1)C(=O)C(C)C

Isomeric SMILES

CCC[C@@H](C(C)C)[NH2+]C[C@H]1CCCN(C1)C(=O)C(C)C

InChI

InChI=1S/C17H34N2O/c1-6-8-16(13(2)3)18-11-15-9-7-10-19(12-15)17(20)14(4)5/h13-16,18H,6-12H2,1-5H3/p+1/t15-,16+/m1/s1