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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-8-ethylsulfonyl-2-methyl-3-oxidanylidene-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-8-ethylsulfonyl-2-methyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-8-ethylsulfonyl-2-methyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-8-ethylsulfonyl-2-methyl-3-oxo-4-oxa-8-azaspiro[4.5]dec-1-ene-1-carboxamide Traditional Name: 8-esyl-3-keto-2-methyl-N-veratryl-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:

CCS(=O)(=O)N1CCC2(CC1)C(=C(C(=O)O2)C)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCS(=O)(=O)N1CCC2(CC1)C(=C(C(=O)O2)C)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H28N2O7S/c1-5-31(26,27)23-10-8-21(9-11-23)18(14(2)20(25)30-21)19(24)22-13-15-6-7-16(28-3)17(12-15)29-4/h6-7,12H,5,8-11,13H2,1-4H3,(H,22,24)