6-azanyl-9-ethynyl-4-methoxy-7,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione

Systemtic Name: 6-azanyl-9-ethynyl-4-methoxy-7,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione Openeye Name: 6-amino-9-ethynyl-7,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione CAS Name: 6-amino-9-ethynyl-7,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione IUPAC Name: 6-amino-9-ethynyl-7,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione Traditional Name: 6-amino-9-ethynyl-7,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone Formula: C21H17NO6 MolecularWeight: 379.36278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=C4CC(CC(C4=C3N)O)(C#C)O)O

Isomeric SMILES

COC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=C4CC(CC(C4=C3N)O)(C#C)O)O

InChI

InChI=1S/C21H17NO6/c1-3-21(27)7-10-13(11(23)8-21)17(22)15-16(19(10)25)18(24)9-5-4-6-12(28-2)14(9)20(15)26/h1,4-6,11,23,25,27H,7-8,22H2,2H3