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

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-naphthalen-1-yloxy-ethanone Openeye Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(1-naphthyloxy)ethanone CAS Name: 1-[4-(1-azepanylsulfonyl)-1-piperazinyl]-2-(1-naphthalenyloxy)ethanone IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-naphthalen-1-yloxyethanone Traditional Name: 1-[4-(azepan-1-ylsulfonyl)piperazino]-2-(1-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=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC4=CC=CC=C43

InChI

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