3-methyl-4-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-anthracene-2,9,10-trione

Systemtic Name: 3-methyl-4-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-anthracene-2,9,10-trione Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)ethyl]-3-methyl-3,4-dihydro-1H-anthracene-2,9,10-trione CAS Name: 3-methyl-4-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-3,4-dihydro-1H-anthracene-2,9,10-trione IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)ethyl]-3-methyl-3,4-dihydro-1H-anthracene-2,9,10-trione Traditional Name: 4-[2-(4-benzylpiperazino)ethyl]-3-methyl-3,4-dihydro-1H-anthracene-2,9,10-trione Formula: C28H30N2O3 MolecularWeight: 442.5494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(CC1=O)C(=O)C3=CC=CC=C3C2=O)CCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1C(C2=C(CC1=O)C(=O)C3=CC=CC=C3C2=O)CCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H30N2O3/c1-19-21(11-12-29-13-15-30(16-14-29)18-20-7-3-2-4-8-20)26-24(17-25(19)31)27(32)22-9-5-6-10-23(22)28(26)33/h2-10,19,21H,11-18H2,1H3