[(1S,2R)-1-(4-methylphenyl)-2-[(2S)-octan-2-yl]oxy-propyl]azanium

Systemtic Name: [(1S,2R)-1-(4-methylphenyl)-2-[(2S)-octan-2-yl]oxy-propyl]azanium Openeye Name: [(1S,2R)-2-[(1S)-1-methylheptoxy]-1-(p-tolyl)propyl]ammonium CAS Name: [(1S,2R)-1-(4-methylphenyl)-2-[(2S)-octan-2-yl]oxypropyl]ammonium IUPAC Name: [(1S,2R)-1-(4-methylphenyl)-2-[(2S)-octan-2-yl]oxypropyl]azanium Traditional Name: [(1S,2R)-2-[(1S)-1-methylheptoxy]-1-(p-tolyl)propyl]ammonium Formula: C18H32NO+ MolecularWeight: 278.45278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(C)C(C1=CC=C(C=C1)C)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)O[C@H](C)[C@H](C1=CC=C(C=C1)C)[NH3+]

InChI

InChI=1S/C18H31NO/c1-5-6-7-8-9-15(3)20-16(4)18(19)17-12-10-14(2)11-13-17/h10-13,15-16,18H,5-9,19H2,1-4H3/p+1/t15-,16+,18+/m0/s1