1-azanyl-2-[2-[(3-chlorophenyl)amino]ethoxy]-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-[2-[(3-chlorophenyl)amino]ethoxy]-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-amino-2-[2-(3-chloroanilino)ethoxy]-4-hydroxy-anthracene-9,10-dione CAS Name: 1-amino-2-[2-(3-chloroanilino)ethoxy]-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-amino-2-[2-(3-chloroanilino)ethoxy]-4-hydroxyanthracene-9,10-dione Traditional Name: 1-amino-2-[2-(3-chloroanilino)ethoxy]-4-hydroxy-9,10-anthraquinone Formula: C22H17ClN2O4 MolecularWeight: 408.83438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCNC4=CC(=CC=C4)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCNC4=CC(=CC=C4)Cl)N

InChI

InChI=1S/C22H17ClN2O4/c23-12-4-3-5-13(10-12)25-8-9-29-17-11-16(26)18-19(20(17)24)22(28)15-7-2-1-6-14(15)21(18)27/h1-7,10-11,25-26H,8-9,24H2