N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-9-oxo-bicyclo[3.3.1]nonane-3-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-9-oxo-3-bicyclo[3.3.1]nonanecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-9-keto-bicyclo[3.3.1]nonane-3-carboxamide Formula: C23H32N2O4S MolecularWeight: 432.57618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC3CCCC(C2)C3=O)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC3CCCC(C2)C3=O)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H32N2O4S/c1-16-9-10-20(15-21(16)30(28,29)25-11-4-2-3-5-12-25)24-23(27)19-13-17-7-6-8-18(14-19)22(17)26/h9-10,15,17-19H,2-8,11-14H2,1H3,(H,24,27)