2-bromanyl-3-[(2-chlorophenyl)methylamino]anthracene-1,4-dione

Systemtic Name: 2-bromanyl-3-[(2-chlorophenyl)methylamino]anthracene-1,4-dione Openeye Name: 2-bromo-3-[(2-chlorophenyl)methylamino]anthracene-1,4-dione CAS Name: 2-bromo-3-[(2-chlorophenyl)methylamino]anthracene-1,4-dione IUPAC Name: 2-bromo-3-[(2-chlorophenyl)methylamino]anthracene-1,4-dione Traditional Name: 2-bromo-3-[(2-chlorobenzyl)amino]-1,4-anthraquinone Formula: C21H13BrClNO2 MolecularWeight: 426.69042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)C(=O)C(=C(C3=O)Br)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)C(=O)C(=C(C3=O)Br)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C21H13BrClNO2/c22-18-19(24-11-14-7-3-4-8-17(14)23)21(26)16-10-13-6-2-1-5-12(13)9-15(16)20(18)25/h1-10,24H,11H2