[(1S)-1-(4-methoxyphenyl)propyl]-[(2R)-5-methylhexan-2-yl]azanium

Systemtic Name: [(1S)-1-(4-methoxyphenyl)propyl]-[(2R)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1,4-dimethylpentyl]-[(1S)-1-(4-methoxyphenyl)propyl]ammonium CAS Name: [(1S)-1-(4-methoxyphenyl)propyl]-[(2R)-5-methylhexan-2-yl]ammonium IUPAC Name: [(1S)-1-(4-methoxyphenyl)propyl]-[(2R)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1,4-dimethylpentyl]-[(1S)-1-(4-methoxyphenyl)propyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)[NH2+]C(C)CCC(C)C

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)OC)[NH2+][C@H](C)CCC(C)C

InChI

InChI=1S/C17H29NO/c1-6-17(18-14(4)8-7-13(2)3)15-9-11-16(19-5)12-10-15/h9-14,17-18H,6-8H2,1-5H3/p+1/t14-,17+/m1/s1