N'-(4-ethyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-(4-ethyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-(4-ethyl-3-morpholinosulfonyl-benzoyl)-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[[4-ethyl-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-(4-ethyl-3-morpholin-4-ylsulfonylbenzoyl)-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-(4-ethyl-3-morpholinosulfonyl-benzoyl)-1,3-benzodioxole-5-carbohydrazide Formula: C21H23N3O7S MolecularWeight: 461.48822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H23N3O7S/c1-2-14-3-4-16(12-19(14)32(27,28)24-7-9-29-10-8-24)21(26)23-22-20(25)15-5-6-17-18(11-15)31-13-30-17/h3-6,11-12H,2,7-10,13H2,1H3,(H,22,25)(H,23,26)