N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-homoveratryl-2-methyl-5-morpholinosulfonyl-benzamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O6S/c1-16-4-6-18(31(26,27)24-10-12-30-13-11-24)15-19(16)22(25)23-9-8-17-5-7-20(28-2)21(14-17)29-3/h4-7,14-15H,8-13H2,1-3H3,(H,23,25)