N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-8-methylsulfonyl-3-oxidanylidene-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-8-methylsulfonyl-3-oxidanylidene-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-8-methylsulfonyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-8-methylsulfonyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-8-methylsulfonyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Traditional Name: N-homoveratryl-3-keto-8-mesyl-2-methyl-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Formula: C21H28N2O7S MolecularWeight: 452.52122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2(CCN(CC2)S(=O)(=O)C)OC1=O)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C2(CCN(CC2)S(=O)(=O)C)OC1=O)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H28N2O7S/c1-14-18(21(30-20(14)25)8-11-23(12-9-21)31(4,26)27)19(24)22-10-7-15-5-6-16(28-2)17(13-15)29-3/h5-6,13H,7-12H2,1-4H3,(H,22,24)