N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanamide Traditional Name: N-homoveratryl-3-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]propionamide Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)NCCC3=CC(=C(C=C3)OC)OC)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)NCCC3=CC(=C(C=C3)OC)OC)OC1=O

InChI

InChI=1S/C21H24N2O7S/c1-23-16-6-5-15(13-18(16)30-21(23)25)31(26,27)11-9-20(24)22-10-8-14-4-7-17(28-2)19(12-14)29-3/h4-7,12-13H,8-11H2,1-3H3,(H,22,24)