[(2S)-2-methylpentyl]-[(3,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-2-methylpentyl]-[(3,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: [(2S)-2-methylpentyl]-[(3,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: [(2S)-2-methylpentyl]-[(3,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-methylpentyl]-[(3,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: [(2S)-2-methylpentyl]-(3,4,5-trimethoxybenzyl)ammonium Formula: C16H28NO3+ MolecularWeight: 282.39842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C[NH2+]CC1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

CCC[C@H](C)C[NH2+]CC1=CC(=C(C(=C1)OC)OC)OC

InChI

InChI=1S/C16H27NO3/c1-6-7-12(2)10-17-11-13-8-14(18-3)16(20-5)15(9-13)19-4/h8-9,12,17H,6-7,10-11H2,1-5H3/p+1/t12-/m0/s1