[4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]methyl 2-azanylpropanoate

Systemtic Name: [4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]methyl 2-azanylpropanoate Openeye Name: (4,5-dihydroxy-9,10-dioxo-2-anthryl)methyl 2-aminopropanoate CAS Name: 2-aminopropanoic acid (4,5-dihydroxy-9,10-dioxo-2-anthracenyl)methyl ester IUPAC Name: (4,5-dihydroxy-9,10-dioxoanthracen-2-yl)methyl 2-aminopropanoate Traditional Name: 2-aminopropionic acid (4,5-dihydroxy-9,10-diketo-2-anthryl)methyl ester Formula: C18H15NO6 MolecularWeight: 341.3148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC(=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O)O)N

Isomeric SMILES

CC(C(=O)OCC1=CC(=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O)O)N

InChI

InChI=1S/C18H15NO6/c1-8(19)18(24)25-7-9-5-11-15(13(21)6-9)17(23)14-10(16(11)22)3-2-4-12(14)20/h2-6,8,20-21H,7,19H2,1H3