2-(3,5-dimethylphenoxy)-N-methyl-N-[(3-morpholin-4-ylsulfonylphenyl)methyl]ethanamine

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-methyl-N-[(3-morpholin-4-ylsulfonylphenyl)methyl]ethanamine Openeye Name: 2-(3,5-dimethylphenoxy)-N-methyl-N-[(3-morpholinosulfonylphenyl)methyl]ethanamine CAS Name: 2-(3,5-dimethylphenoxy)-N-methyl-N-[[3-(4-morpholinylsulfonyl)phenyl]methyl]ethanamine IUPAC Name: 2-(3,5-dimethylphenoxy)-N-methyl-N-[(3-morpholin-4-ylsulfonylphenyl)methyl]ethanamine Traditional Name: 2-(3,5-dimethylphenoxy)ethyl-methyl-(3-morpholinosulfonylbenzyl)amine Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN(C)CC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN(C)CC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C22H30N2O4S/c1-18-13-19(2)15-21(14-18)28-12-7-23(3)17-20-5-4-6-22(16-20)29(25,26)24-8-10-27-11-9-24/h4-6,13-16H,7-12,17H2,1-3H3