2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine; 1-(phenylsulfonyl)-2-propoxy-benzene; hydrochloride

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine; 1-(phenylsulfonyl)-2-propoxy-benzene; hydrochloride Openeye Name: 1-(benzenesulfonyl)-2-propoxy-benzene; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine; hydrochloride CAS Name: 1-(benzenesulfonyl)-2-propoxybenzene; 2-(3,4-dimethoxyphenyl)-N-methylethanamine; hydrochloride IUPAC Name: 1-(benzenesulfonyl)-2-propoxybenzene; 2-(3,4-dimethoxyphenyl)-N-methylethanamine; hydrochloride Traditional Name: 1-besyl-2-propoxy-benzene; homoveratryl(methyl)amine; hydrochloride Formula: C26H34ClNO5S MolecularWeight: 508.06986

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2.CNCCC1=CC(=C(C=C1)OC)OC.Cl

Isomeric SMILES

CCCOC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2.CNCCC1=CC(=C(C=C1)OC)OC.Cl

InChI

InChI=1S/C15H16O3S.C11H17NO2.ClH/c1-2-12-18-14-10-6-7-11-15(14)19(16,17)13-8-4-3-5-9-13;1-12-7-6-9-4-5-10(13-2)11(8-9)14-3;/h3-11H,2,12H2,1H3;4-5,8,12H,6-7H2,1-3H3;1H