1-[(1-azanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-yl)methyl]-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-[(1-azanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-yl)methyl]-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-[(1-amino-6-oxo-cyclohexa-2,4-dien-1-yl)methyl]-4-hydroxy-anthracene-9,10-dione CAS Name: 1-[(1-amino-6-oxo-1-cyclohexa-2,4-dienyl)methyl]-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-[(1-amino-6-oxocyclohexa-2,4-dien-1-yl)methyl]-4-hydroxyanthracene-9,10-dione Traditional Name: 1-[(1-amino-6-keto-cyclohexa-2,4-dien-1-yl)methyl]-4-hydroxy-9,10-anthraquinone Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)CC4(C=CC=CC4=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)CC4(C=CC=CC4=O)N

InChI

InChI=1S/C21H15NO4/c22-21(10-4-3-7-16(21)24)11-12-8-9-15(23)18-17(12)19(25)13-5-1-2-6-14(13)20(18)26/h1-10,23H,11,22H2