1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]sulfonylazepane Traditional Name: 1-(4-p-phenetylsulfonylpiperazino)sulfonylazepane Formula: C18H29N3O5S2 MolecularWeight: 431.56996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H29N3O5S2/c1-2-26-17-7-9-18(10-8-17)27(22,23)19-13-15-21(16-14-19)28(24,25)20-11-5-3-4-6-12-20/h7-10H,2-6,11-16H2,1H3