N-[6-[2-(4-tert-butylphenyl)carbonylhydrazinyl]-6-oxidanylidene-hexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[6-[2-(4-tert-butylphenyl)carbonylhydrazinyl]-6-oxidanylidene-hexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[6-[2-(4-tert-butylbenzoyl)hydrazino]-6-oxo-hexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[6-[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-6-oxohexyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[6-[2-(4-tert-butylbenzoyl)hydrazinyl]-6-oxohexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[6-[N'-(4-tert-butylbenzoyl)hydrazino]-6-keto-hexyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)CCCCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)CCCCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C25H33N3O6S/c1-25(2,3)19-10-8-18(9-11-19)24(30)28-27-23(29)7-5-4-6-14-26-35(31,32)20-12-13-21-22(17-20)34-16-15-33-21/h8-13,17,26H,4-7,14-16H2,1-3H3,(H,27,29)(H,28,30)