N-[(2,4,5-trimethoxyphenyl)methyl]octan-1-amine hydrochloride

Systemtic Name: N-[(2,4,5-trimethoxyphenyl)methyl]octan-1-amine hydrochloride Openeye Name: N-[(2,4,5-trimethoxyphenyl)methyl]octan-1-amine hydrochloride CAS Name: N-[(2,4,5-trimethoxyphenyl)methyl]-1-octanamine hydrochloride IUPAC Name: N-[(2,4,5-trimethoxyphenyl)methyl]octan-1-amine hydrochloride Traditional Name: octyl-(2,4,5-trimethoxybenzyl)amine hydrochloride Formula: C18H32ClNO3 MolecularWeight: 345.90458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCC1=CC(=C(C=C1OC)OC)OC.Cl

Isomeric SMILES

CCCCCCCCNCC1=CC(=C(C=C1OC)OC)OC.Cl

InChI

InChI=1S/C18H31NO3.ClH/c1-5-6-7-8-9-10-11-19-14-15-12-17(21-3)18(22-4)13-16(15)20-2;/h12-13,19H,5-11,14H2,1-4H3;1H