N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[4-(2-methylphenyl)piperazin-1-yl]propanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[4-(2-methylphenyl)piperazin-1-yl]propanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-[4-(o-tolyl)piperazin-1-yl]propanamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[4-(2-methylphenyl)-1-piperazinyl]propanamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-[4-(2-methylphenyl)piperazin-1-yl]propanamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[4-(o-tolyl)piperazino]propionamide Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(C)C(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(C)C(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H27N3O3/c1-18-7-3-6-10-25(18)31-15-13-30(14-16-31)19(2)28(34)29-20-11-12-23-24(17-20)27(33)22-9-5-4-8-21(22)26(23)32/h3-12,17,19H,13-16H2,1-2H3,(H,29,34)