2-phenyl-2-[4-(4-phenylpiperazin-1-yl)but-2-ynyl]indene-1,3-dione

Systemtic Name: 2-phenyl-2-[4-(4-phenylpiperazin-1-yl)but-2-ynyl]indene-1,3-dione Openeye Name: 2-phenyl-2-[4-(4-phenylpiperazin-1-yl)but-2-ynyl]indane-1,3-dione CAS Name: 2-phenyl-2-[4-(4-phenyl-1-piperazinyl)but-2-ynyl]indene-1,3-dione IUPAC Name: 2-phenyl-2-[4-(4-phenylpiperazin-1-yl)but-2-ynyl]indene-1,3-dione Traditional Name: 2-phenyl-2-[4-(4-phenylpiperazino)but-2-ynyl]indane-1,3-quinone Formula: C29H26N2O2 MolecularWeight: 434.52894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#CCC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC#CCC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O2/c32-27-25-15-7-8-16-26(25)28(33)29(27,23-11-3-1-4-12-23)17-9-10-18-30-19-21-31(22-20-30)24-13-5-2-6-14-24/h1-8,11-16H,17-22H2