2-[4-(4-ethoxyphenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(4-ethoxyphenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(4-ethoxyphenyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(4-ethoxyphenyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(4-ethoxyphenyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-(4-p-phenetylpiperazino)sulfonylbenzonitrile Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C19H21N3O3S/c1-2-25-18-9-7-17(8-10-18)21-11-13-22(14-12-21)26(23,24)19-6-4-3-5-16(19)15-20/h3-10H,2,11-14H2,1H3