4-chloranyl-N-[[1-(dimethylamino)cycloheptyl]methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[[1-(dimethylamino)cycloheptyl]methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[[1-(dimethylamino)cycloheptyl]methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[[1-(dimethylamino)cycloheptyl]methyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[[1-(dimethylamino)cycloheptyl]methyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[[1-(dimethylamino)cycloheptyl]methyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H32ClN3O3S MolecularWeight: 442.01508

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCCC1)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(C)C1(CCCCCC1)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H32ClN3O3S/c1-24(2)21(11-5-3-4-6-12-21)16-23-20(26)17-9-10-18(22)19(15-17)29(27,28)25-13-7-8-14-25/h9-10,15H,3-8,11-14,16H2,1-2H3,(H,23,26)