[(2R)-3-[(4-methoxyphenyl)methoxy]-2-oxidanyl-propyl]-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [(2R)-3-[(4-methoxyphenyl)methoxy]-2-oxidanyl-propyl]-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[(2R)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]ammonium CAS Name: [(2R)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: [(2R)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-[(2R)-2-hydroxy-3-p-anisyloxy-propyl]ammonium Formula: C18H32NO3+ MolecularWeight: 310.45158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC(COCC1=CC=C(C=C1)OC)O

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]C[C@H](COCC1=CC=C(C=C1)OC)O

InChI

InChI=1S/C18H31NO3/c1-14(2)5-6-15(3)19-11-17(20)13-22-12-16-7-9-18(21-4)10-8-16/h7-10,14-15,17,19-20H,5-6,11-13H2,1-4H3/p+1/t15-,17+/m0/s1