2-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2-isopropoxyethyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(2-propan-2-yloxyethyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2-isopropoxyethyl)piperazino]sulfonylbenzonitrile Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

CC(C)OCCN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C16H23N3O3S/c1-14(2)22-12-11-18-7-9-19(10-8-18)23(20,21)16-6-4-3-5-15(16)13-17/h3-6,14H,7-12H2,1-2H3