1-[3-[4-(2-azanylethanoyl)piperazin-1-yl]propoxy]-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile

Systemtic Name: 1-[3-[4-(2-azanylethanoyl)piperazin-1-yl]propoxy]-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile Openeye Name: 1-[3-[4-(2-aminoacetyl)piperazin-1-yl]propoxy]-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile CAS Name: 1-[3-[4-(2-amino-1-oxoethyl)-1-piperazinyl]propoxy]-4-phenyl-1-cyclohexa-2,5-dienecarbonitrile IUPAC Name: 1-[3-[4-(2-aminoacetyl)piperazin-1-yl]propoxy]-4-phenylcyclohexa-2,5-diene-1-carbonitrile Traditional Name: 1-[3-(4-glycylpiperazino)propoxy]-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2(C=CC(C=C2)C3=CC=CC=C3)C#N)C(=O)CN

Isomeric SMILES

C1CN(CCN1CCCOC2(C=CC(C=C2)C3=CC=CC=C3)C#N)C(=O)CN

InChI

InChI=1S/C22H28N4O2/c23-17-21(27)26-14-12-25(13-15-26)11-4-16-28-22(18-24)9-7-20(8-10-22)19-5-2-1-3-6-19/h1-3,5-10,20H,4,11-17,23H2