2-[4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl]ethanoic acid

Systemtic Name: 2-[4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl]ethanoic acid Openeye Name: 2-[4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthryl)oxy]phenyl]acetic acid CAS Name: 2-[4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]phenyl]acetic acid IUPAC Name: 2-[4-(1-amino-4-hydroxy-9,10-dioxoanthracen-2-yl)oxyphenyl]acetic acid Traditional Name: 2-[4-[(1-amino-4-hydroxy-9,10-diketo-2-anthryl)oxy]phenyl]acetic acid Formula: C22H15NO6 MolecularWeight: 389.3576

Click to see the large picture

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)CC(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=C(C=C4)CC(=O)O)N

InChI

InChI=1S/C22H15NO6/c23-20-16(29-12-7-5-11(6-8-12)9-17(25)26)10-15(24)18-19(20)22(28)14-4-2-1-3-13(14)21(18)27/h1-8,10,24H,9,23H2,(H,25,26)