1-azanyl-4-oxidanyl-2-(2-oxidanyl-3-phenylazanyl-propoxy)anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-oxidanyl-2-(2-oxidanyl-3-phenylazanyl-propoxy)anthracene-9,10-dione Openeye Name: 1-amino-2-(3-anilino-2-hydroxy-propoxy)-4-hydroxy-anthracene-9,10-dione CAS Name: 1-amino-2-(3-anilino-2-hydroxypropoxy)-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-amino-2-(3-anilino-2-hydroxypropoxy)-4-hydroxyanthracene-9,10-dione Traditional Name: 1-amino-2-(3-anilino-2-hydroxy-propoxy)-4-hydroxy-9,10-anthraquinone Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC(COC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N)O

Isomeric SMILES

C1=CC=C(C=C1)NCC(COC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N)O

InChI

InChI=1S/C23H20N2O5/c24-21-18(30-12-14(26)11-25-13-6-2-1-3-7-13)10-17(27)19-20(21)23(29)16-9-5-4-8-15(16)22(19)28/h1-10,14,25-27H,11-12,24H2