4-azanyl-3-[9,10-bis(oxidanylidene)anthracen-2-yl]butanoic acid

Systemtic Name: 4-azanyl-3-[9,10-bis(oxidanylidene)anthracen-2-yl]butanoic acid Openeye Name: 4-amino-3-(9,10-dioxo-2-anthryl)butanoic acid CAS Name: 4-amino-3-(9,10-dioxo-2-anthracenyl)butanoic acid IUPAC Name: 4-amino-3-(9,10-dioxoanthracen-2-yl)butanoic acid Traditional Name: 4-amino-3-(9,10-diketo-2-anthryl)butyric acid Formula: C18H15NO4 MolecularWeight: 309.316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(CC(=O)O)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(CC(=O)O)CN

InChI

InChI=1S/C18H15NO4/c19-9-11(8-16(20)21)10-5-6-14-15(7-10)18(23)13-4-2-1-3-12(13)17(14)22/h1-7,11H,8-9,19H2,(H,20,21)