2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]acetonitrile CAS Name: 2-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]acetonitrile Traditional Name: 2-(4-p-phenetylsulfonylpiperazino)acetonitrile Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC#N

InChI

InChI=1S/C14H19N3O3S/c1-2-20-13-3-5-14(6-4-13)21(18,19)17-11-9-16(8-7-15)10-12-17/h3-6H,2,8-12H2,1H3