2-[4-(diphenylmethyl)piperazin-1-yl]cyclohepta[b]pyrrole-3-carbonitrile

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]cyclohepta[b]pyrrole-3-carbonitrile Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)cyclohepta[b]pyrrole-3-carbonitrile CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-3-cyclohepta[b]pyrrolecarbonitrile IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)cyclohepta[b]pyrrole-3-carbonitrile Traditional Name: 2-(4-benzhydrylpiperazino)cyclohepta[b]pyrrole-3-carbonitrile Formula: C27H24N4 MolecularWeight: 404.50626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C3=CC=CC=CC3=N2)C#N)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C3=CC=CC=CC3=N2)C#N)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4/c28-20-24-23-14-8-3-9-15-25(23)29-27(24)31-18-16-30(17-19-31)26(21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-15,26H,16-19H2