5-[4-[9,10-bis(oxidanylidene)anthracen-2-yl]piperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-[9,10-bis(oxidanylidene)anthracen-2-yl]piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(9,10-dioxo-2-anthryl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[4-(9,10-dioxo-2-anthracenyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-(9,10-dioxoanthracen-2-yl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[4-(9,10-diketo-2-anthryl)piperazino]-5-keto-valeric acid Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)C(=O)CCCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)C(=O)CCCC(=O)O

InChI

InChI=1S/C23H22N2O5/c26-20(6-3-7-21(27)28)25-12-10-24(11-13-25)15-8-9-18-19(14-15)23(30)17-5-2-1-4-16(17)22(18)29/h1-2,4-5,8-9,14H,3,6-7,10-13H2,(H,27,28)