1,4-bis[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]anthracene-9,10-dione

Systemtic Name: 1,4-bis[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]anthracene-9,10-dione Openeye Name: 1,4-bis[(9,10-dioxo-1-anthryl)amino]anthracene-9,10-dione CAS Name: 1,4-bis[(9,10-dioxo-1-anthracenyl)amino]anthracene-9,10-dione IUPAC Name: 1,4-bis[(9,10-dioxoanthracen-1-yl)amino]anthracene-9,10-dione Traditional Name: 1,4-bis[(9,10-diketo-1-anthryl)amino]-9,10-anthraquinone Formula: C42H22N2O6 MolecularWeight: 650.63388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=C5C(=C(C=C4)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=O)C(=O)C9=CC=CC=C9C5=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=C5C(=C(C=C4)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=O)C(=O)C9=CC=CC=C9C5=O

InChI

InChI=1S/C42H22N2O6/c45-37-21-9-1-3-11-23(21)39(47)33-27(37)15-7-17-29(33)43-31-19-20-32(36-35(31)41(49)25-13-5-6-14-26(25)42(36)50)44-30-18-8-16-28-34(30)40(48)24-12-4-2-10-22(24)38(28)46/h1-20,43-44H