N-(3-chloranyl-4-ethoxy-phenyl)methanesulfonamide; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine

Systemtic Name: N-(3-chloranyl-4-ethoxy-phenyl)methanesulfonamide; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine Openeye Name: N-(3-chloro-4-ethoxy-phenyl)methanesulfonamide; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine CAS Name: N-(3-chloro-4-ethoxyphenyl)methanesulfonamide; 2-(3,4-dimethoxyphenyl)-N-methylethanamine IUPAC Name: N-(3-chloro-4-ethoxyphenyl)methanesulfonamide; 2-(3,4-dimethoxyphenyl)-N-methylethanamine Traditional Name: N-(3-chloro-4-ethoxy-phenyl)methanesulfonamide; homoveratryl(methyl)amine Formula: C20H29ClN2O5S MolecularWeight: 444.97266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C)Cl.CNCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C)Cl.CNCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C11H17NO2.C9H12ClNO3S/c1-12-7-6-9-4-5-10(13-2)11(8-9)14-3;1-3-14-9-5-4-7(6-8(9)10)11-15(2,12)13/h4-5,8,12H,6-7H2,1-3H3;4-6,11H,3H2,1-2H3