N-[3-[2-(4-ethoxy-3-methoxy-phenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[3-[2-(4-ethoxy-3-methoxy-phenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-[2-(4-ethoxy-3-methoxy-benzoyl)hydrazino]-3-oxo-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-[[(4-ethoxy-3-methoxyphenyl)-oxomethyl]hydrazo]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-[2-(4-ethoxy-3-methoxybenzoyl)hydrazinyl]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-[N'-(4-ethoxy-3-methoxy-benzoyl)hydrazino]-3-keto-propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C22H27N3O8S MolecularWeight: 493.53008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NNC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NNC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)OC

InChI

InChI=1S/C22H27N3O8S/c1-3-31-17-7-5-15(13-19(17)30-2)22(27)25-24-21(26)9-10-23-34(28,29)16-6-8-18-20(14-16)33-12-4-11-32-18/h5-8,13-14,23H,3-4,9-12H2,1-2H3,(H,24,26)(H,25,27)