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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-8-methylsulfonyl-3-oxidanylidene-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-8-methylsulfonyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-8-methylsulfonyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-8-methylsulfonyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Traditional Name: 3-keto-8-mesyl-2-methyl-N-veratryl-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Formula: C20H26N2O7S MolecularWeight: 438.49464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2(CCN(CC2)S(=O)(=O)C)OC1=O)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C2(CCN(CC2)S(=O)(=O)C)OC1=O)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H26N2O7S/c1-13-17(18(23)21-12-14-5-6-15(27-2)16(11-14)28-3)20(29-19(13)24)7-9-22(10-8-20)30(4,25)26/h5-6,11H,7-10,12H2,1-4H3,(H,21,23)