3-cyano-N-[3-[4-methoxy-3-(piperazin-1-ylmethyl)phenyl]phenyl]benzamide

Systemtic Name: 3-cyano-N-[3-[4-methoxy-3-(piperazin-1-ylmethyl)phenyl]phenyl]benzamide Openeye Name: 3-cyano-N-[3-[4-methoxy-3-(piperazin-1-ylmethyl)phenyl]phenyl]benzamide CAS Name: 3-cyano-N-[3-[4-methoxy-3-(1-piperazinylmethyl)phenyl]phenyl]benzamide IUPAC Name: 3-cyano-N-[3-[4-methoxy-3-(piperazin-1-ylmethyl)phenyl]phenyl]benzamide Traditional Name: 3-cyano-N-[3-[4-methoxy-3-(piperazinomethyl)phenyl]phenyl]benzamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC(=C3)C#N)CN4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC(=C3)C#N)CN4CCNCC4

InChI

InChI=1S/C26H26N4O2/c1-32-25-9-8-21(15-23(25)18-30-12-10-28-11-13-30)20-5-3-7-24(16-20)29-26(31)22-6-2-4-19(14-22)17-27/h2-9,14-16,28H,10-13,18H2,1H3,(H,29,31)