3-(azepan-1-ylsulfonyl)-N'-[2-(2,3-dimethylphenoxy)propanoyl]benzohydrazide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(2,3-dimethylphenoxy)propanoyl]benzohydrazide Openeye Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(2,3-dimethylphenoxy)propanoyl]benzohydrazide CAS Name: 3-(1-azepanylsulfonyl)-N'-[2-(2,3-dimethylphenoxy)-1-oxopropyl]benzohydrazide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(2,3-dimethylphenoxy)propanoyl]benzohydrazide Traditional Name: 3-(azepan-1-ylsulfonyl)-N'-[2-(2,3-dimethylphenoxy)propanoyl]benzohydrazide Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C24H31N3O5S/c1-17-10-8-13-22(18(17)2)32-19(3)23(28)25-26-24(29)20-11-9-12-21(16-20)33(30,31)27-14-6-4-5-7-15-27/h8-13,16,19H,4-7,14-15H2,1-3H3,(H,25,28)(H,26,29)