N-[(3,4-dimethoxyphenyl)methyl]-2-oxidanylidene-N-prop-2-enyl-3H-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-oxidanylidene-N-prop-2-enyl-3H-1,3-benzoxazole-6-sulfonamide Openeye Name: N-allyl-N-[(3,4-dimethoxyphenyl)methyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-oxo-N-prop-2-enyl-3H-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-oxo-N-prop-2-enyl-3H-1,3-benzoxazole-6-sulfonamide Traditional Name: N-allyl-2-keto-N-veratryl-3H-1,3-benzoxazole-6-sulfonamide Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC=C)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC=C)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3)OC

InChI

InChI=1S/C19H20N2O6S/c1-4-9-21(12-13-5-8-16(25-2)18(10-13)26-3)28(23,24)14-6-7-15-17(11-14)27-19(22)20-15/h4-8,10-11H,1,9,12H2,2-3H3,(H,20,22)