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

Systemtic Name: N-[3-[2-(3,5-dimethoxyphenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-[2-(3,5-dimethoxybenzoyl)hydrazino]-3-oxo-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-[2-(3,5-dimethoxybenzoyl)hydrazinyl]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-[N'-(3,5-dimethoxybenzoyl)hydrazino]-3-keto-propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C21H25N3O8S MolecularWeight: 479.5035

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NNC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NNC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)OC

InChI

InChI=1S/C21H25N3O8S/c1-29-15-10-14(11-16(12-15)30-2)21(26)24-23-20(25)6-7-22-33(27,28)17-4-5-18-19(13-17)32-9-3-8-31-18/h4-5,10-13,22H,3,6-9H2,1-2H3,(H,23,25)(H,24,26)