1-[4-[4-(anthracen-9-ylmethyl)piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(anthracen-9-ylmethyl)piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(9-anthrylmethyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(9-anthracenylmethyl)-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(anthracen-9-ylmethyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(9-anthrylmethyl)piperazino]phenyl]ethanone Formula: C27H26N2O MolecularWeight: 394.50814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C27H26N2O/c1-20(30)21-10-12-24(13-11-21)29-16-14-28(15-17-29)19-27-25-8-4-2-6-22(25)18-23-7-3-5-9-26(23)27/h2-13,18H,14-17,19H2,1H3