4-[[4-[3,4-dimethoxy-5-[(E)-prop-1-enyl]phenyl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[3,4-dimethoxy-5-[(E)-prop-1-enyl]phenyl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3,4-dimethoxy-5-[(E)-prop-1-enyl]benzoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[3,4-dimethoxy-5-[(E)-prop-1-enyl]phenyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[3,4-dimethoxy-5-[(E)-prop-1-enyl]benzoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3,4-dimethoxy-5-[(E)-prop-1-enyl]benzoyl]piperazino]methyl]benzonitrile Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)OC)OC

Isomeric SMILES

C/C=C/C1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)OC)OC

InChI

InChI=1S/C24H27N3O3/c1-4-5-20-14-21(15-22(29-2)23(20)30-3)24(28)27-12-10-26(11-13-27)17-19-8-6-18(16-25)7-9-19/h4-9,14-15H,10-13,17H2,1-3H3/b5-4+