1-[[3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-7-oxidanylidene-benzo[a]phenalen-9-yl]amino]anthracene-9,10-dione

Systemtic Name: 1-[[3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-7-oxidanylidene-benzo[a]phenalen-9-yl]amino]anthracene-9,10-dione Openeye Name: 1-[[3-[(9,10-dioxo-1-anthryl)amino]-7-oxo-benzo[a]phenalen-9-yl]amino]anthracene-9,10-dione CAS Name: 1-[[3-[(9,10-dioxo-1-anthracenyl)amino]-7-oxo-9-benzo[a]phenalenyl]amino]anthracene-9,10-dione IUPAC Name: 1-[[3-[(9,10-dioxoanthracen-1-yl)amino]-7-oxobenzo[a]phenalen-9-yl]amino]anthracene-9,10-dione Traditional Name: 1-[[3-[(9,10-diketo-1-anthryl)amino]-7-keto-benzo[a]phenalen-9-yl]amino]-9,10-anthraquinone Formula: C45H24N2O5 MolecularWeight: 672.68246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC5=C(C=C4)C6=C7C(=C(C=C6)NC8=CC=CC9=C8C(=O)C1=CC=CC=C1C9=O)C=CC=C7C5=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC5=C(C=C4)C6=C7C(=C(C=C6)NC8=CC=CC9=C8C(=O)C1=CC=CC=C1C9=O)C=CC=C7C5=O

InChI

InChI=1S/C45H24N2O5/c48-41-26-8-1-3-10-28(26)44(51)39-32(41)14-6-16-36(39)46-23-18-19-24-25-20-21-35(30-12-5-13-31(38(25)30)43(50)34(24)22-23)47-37-17-7-15-33-40(37)45(52)29-11-4-2-9-27(29)42(33)49/h1-22,46-47H