[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-methoxy-2-oxidanyl-phenyl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-methoxy-2-oxidanyl-phenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(2-hydroxy-4-methoxy-phenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(2-hydroxy-4-methoxyphenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(2-hydroxy-4-methoxyphenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(2-hydroxy-4-methoxy-phenyl)methanone Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)O

InChI

InChI=1S/C18H27N3O5S/c1-26-15-6-7-16(17(22)14-15)18(23)19-10-12-21(13-11-19)27(24,25)20-8-4-2-3-5-9-20/h6-7,14,22H,2-5,8-13H2,1H3