(3-ethoxy-4-oxidanyl-phenyl)methyl-[(2R)-6-methylheptan-2-yl]azanium

Systemtic Name: (3-ethoxy-4-oxidanyl-phenyl)methyl-[(2R)-6-methylheptan-2-yl]azanium Openeye Name: [(1R)-1,5-dimethylhexyl]-[(3-ethoxy-4-hydroxy-phenyl)methyl]ammonium CAS Name: (3-ethoxy-4-hydroxyphenyl)methyl-[(2R)-6-methylheptan-2-yl]ammonium IUPAC Name: (3-ethoxy-4-hydroxyphenyl)methyl-[(2R)-6-methylheptan-2-yl]azanium Traditional Name: [(1R)-1,5-dimethylhexyl]-(3-ethoxy-4-hydroxy-benzyl)ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C(C)CCCC(C)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+][C@H](C)CCCC(C)C)O

InChI

InChI=1S/C17H29NO2/c1-5-20-17-11-15(9-10-16(17)19)12-18-14(4)8-6-7-13(2)3/h9-11,13-14,18-19H,5-8,12H2,1-4H3/p+1/t14-/m1/s1