1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-naphthalen-2-yloxy-ethanone

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-naphthalen-2-yloxy-ethanone Openeye Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(2-naphthyloxy)ethanone CAS Name: 1-[4-(1-azepanylsulfonyl)-1-piperazinyl]-2-(2-naphthalenyloxy)ethanone IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-naphthalen-2-yloxyethanone Traditional Name: 1-[4-(azepan-1-ylsulfonyl)piperazino]-2-(2-naphthoxy)ethanone Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H29N3O4S/c26-22(18-29-21-10-9-19-7-3-4-8-20(19)17-21)23-13-15-25(16-14-23)30(27,28)24-11-5-1-2-6-12-24/h3-4,7-10,17H,1-2,5-6,11-16,18H2