N'-[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]carbonyl-3,4-dimethoxy-benzohydrazide

Systemtic Name: N'-[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]carbonyl-3,4-dimethoxy-benzohydrazide Openeye Name: N'-[3-(azepan-1-ylsulfonyl)-4-chloro-benzoyl]-3,4-dimethoxy-benzohydrazide CAS Name: N'-[[3-(1-azepanylsulfonyl)-4-chlorophenyl]-oxomethyl]-3,4-dimethoxybenzohydrazide IUPAC Name: N'-[3-(azepan-1-ylsulfonyl)-4-chlorobenzoyl]-3,4-dimethoxybenzohydrazide Traditional Name: N'-[3-(azepan-1-ylsulfonyl)-4-chloro-benzoyl]-3,4-dimethoxy-benzohydrazide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C22H26ClN3O6S/c1-31-18-10-8-15(13-19(18)32-2)21(27)24-25-22(28)16-7-9-17(23)20(14-16)33(29,30)26-11-5-3-4-6-12-26/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,24,27)(H,25,28)