[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [5-(1-azepanylsulfonyl)-2-chlorophenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-pyrrolidin-1-ylmethanone Traditional Name: [5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-pyrrolidino-methanone Formula: C17H23ClN2O3S MolecularWeight: 370.89412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCCC3

InChI

InChI=1S/C17H23ClN2O3S/c18-16-8-7-14(13-15(16)17(21)19-9-5-6-10-19)24(22,23)20-11-3-1-2-4-12-20/h7-8,13H,1-6,9-12H2