(3-ethoxy-4-methoxy-phenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium

Systemtic Name: (3-ethoxy-4-methoxy-phenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1,4-dimethylpentyl]-[(3-ethoxy-4-methoxy-phenyl)methyl]ammonium CAS Name: (3-ethoxy-4-methoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]ammonium IUPAC Name: (3-ethoxy-4-methoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1,4-dimethylpentyl]-(3-ethoxy-4-methoxy-benzyl)ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C(C)CCC(C)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+][C@H](C)CCC(C)C)OC

InChI

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