1-azanyl-7-chloranyl-2-(2-ethylphenoxy)-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-7-chloranyl-2-(2-ethylphenoxy)-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-amino-7-chloro-2-(2-ethylphenoxy)-4-hydroxy-anthracene-9,10-dione CAS Name: 1-amino-7-chloro-2-(2-ethylphenoxy)-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-amino-7-chloro-2-(2-ethylphenoxy)-4-hydroxyanthracene-9,10-dione Traditional Name: 1-amino-7-chloro-2-(2-ethylphenoxy)-4-hydroxy-9,10-anthraquinone Formula: C22H16ClNO4 MolecularWeight: 393.81974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1OC2=C(C3=C(C(=C2)O)C(=O)C4=C(C3=O)C=C(C=C4)Cl)N

Isomeric SMILES

CCC1=CC=CC=C1OC2=C(C3=C(C(=C2)O)C(=O)C4=C(C3=O)C=C(C=C4)Cl)N

InChI

InChI=1S/C22H16ClNO4/c1-2-11-5-3-4-6-16(11)28-17-10-15(25)18-19(20(17)24)22(27)14-9-12(23)7-8-13(14)21(18)26/h3-10,25H,2,24H2,1H3