2-[4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl]ethyl 4-[3-[4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl]propanoyl]benzoate

Systemtic Name: 2-[4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl]ethyl 4-[3-[4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl]propanoyl]benzoate Openeye Name: 2-[4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthryl)oxy]phenyl]ethyl 4-[3-[4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthryl)oxy]phenyl]propanoyl]benzoate CAS Name: 4-[3-[4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]phenyl]-1-oxopropyl]benzoic acid 2-[4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]phenyl]ethyl ester IUPAC Name: 2-[4-(1-amino-4-hydroxy-9,10-dioxoanthracen-2-yl)oxyphenyl]ethyl 4-[3-[4-(1-amino-4-hydroxy-9,10-dioxoanthracen-2-yl)oxyphenyl]propanoyl]benzoate Traditional Name: 4-[3-[4-[(1-amino-4-hydroxy-9,10-diketo-2-anthryl)oxy]phenyl]propanoyl]benzoic acid 2-[4-[(1-amino-4-hydroxy-9,10-diketo-2-anthryl)oxy]phenyl]ethyl ester Formula: C52H36N2O11 MolecularWeight: 864.84904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=C(C=C4)CCC(=O)C5=CC=C(C=C5)C(=O)OCCC6=CC=C(C=C6)OC7=C(C8=C(C(=C7)O)C(=O)C9=CC=CC=C9C8=O)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=C(C=C4)CCC(=O)C5=CC=C(C=C5)C(=O)OCCC6=CC=C(C=C6)OC7=C(C8=C(C(=C7)O)C(=O)C9=CC=CC=C9C8=O)N)N

InChI

InChI=1S/C52H36N2O11/c53-46-40(25-38(56)42-44(46)50(60)35-7-3-1-5-33(35)48(42)58)64-31-18-9-27(10-19-31)13-22-37(55)29-14-16-30(17-15-29)52(62)63-24-23-28-11-20-32(21-12-28)65-41-26-39(57)43-45(47(41)54)51(61)36-8-4-2-6-34(36)49(43)59/h1-12,14-21,25-26,56-57H,13,22-24,53-54H2