[(3S)-3-(5-methylfuran-2-yl)butyl]-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]azanium

Systemtic Name: [(3S)-3-(5-methylfuran-2-yl)butyl]-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]azanium Openeye Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-[(3S)-3-(5-methyl-2-furyl)butyl]ammonium CAS Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[(3S)-3-(5-methyl-2-furanyl)butyl]ammonium IUPAC Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[(3S)-3-(5-methylfuran-2-yl)butyl]azanium Traditional Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-[(3S)-3-(5-methyl-2-furyl)butyl]ammonium Formula: C17H32NO2+ MolecularWeight: 282.44148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)CC[NH2+]C(C)CCCC(C)(C)O

Isomeric SMILES

CC1=CC=C(O1)[C@@H](C)CC[NH2+][C@H](C)CCCC(C)(C)O

InChI

InChI=1S/C17H31NO2/c1-13(16-9-8-15(3)20-16)10-12-18-14(2)7-6-11-17(4,5)19/h8-9,13-14,18-19H,6-7,10-12H2,1-5H3/p+1/t13-,14+/m0/s1