[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-chloranyl-4-oxidanyl-phenyl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-chloranyl-4-oxidanyl-phenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-chloro-4-hydroxy-phenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(3-chloro-4-hydroxyphenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-chloro-4-hydroxyphenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(3-chloro-4-hydroxy-phenyl)methanone Formula: C17H24ClN3O4S MolecularWeight: 401.90816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)O)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C17H24ClN3O4S/c18-15-13-14(5-6-16(15)22)17(23)19-9-11-21(12-10-19)26(24,25)20-7-3-1-2-4-8-20/h5-6,13,22H,1-4,7-12H2