4-[3-oxidanylidene-3-(4-pentan-3-ylpiperazin-1-yl)propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-oxidanylidene-3-(4-pentan-3-ylpiperazin-1-yl)propoxy]benzenecarbonitrile Openeye Name: 4-[3-[4-(1-ethylpropyl)piperazin-1-yl]-3-oxo-propoxy]benzonitrile CAS Name: 4-[3-oxo-3-(4-pentan-3-yl-1-piperazinyl)propoxy]benzonitrile IUPAC Name: 4-[3-oxo-3-(4-pentan-3-ylpiperazin-1-yl)propoxy]benzonitrile Traditional Name: 4-[3-[4-(1-ethylpropyl)piperazino]-3-keto-propoxy]benzonitrile Formula: C19H27N3O2 MolecularWeight: 329.43658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)CCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)CCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H27N3O2/c1-3-17(4-2)21-10-12-22(13-11-21)19(23)9-14-24-18-7-5-16(15-20)6-8-18/h5-8,17H,3-4,9-14H2,1-2H3