2-[2-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]ethylamino]naphthalene-1,4-dione

Systemtic Name: 2-[2-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]ethylamino]naphthalene-1,4-dione Openeye Name: 2-[2-(3,5-dibromo-4-hydroxy-phenyl)ethylamino]naphthalene-1,4-dione CAS Name: 2-[2-(3,5-dibromo-4-hydroxyphenyl)ethylamino]naphthalene-1,4-dione IUPAC Name: 2-[2-(3,5-dibromo-4-hydroxyphenyl)ethylamino]naphthalene-1,4-dione Traditional Name: 2-[2-(3,5-dibromo-4-hydroxy-phenyl)ethylamino]-1,4-naphthoquinone Formula: C18H13Br2NO3 MolecularWeight: 451.10872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=C(C2=O)NCCC3=CC(=C(C(=C3)Br)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=C(C2=O)NCCC3=CC(=C(C(=C3)Br)O)Br

InChI

InChI=1S/C18H13Br2NO3/c19-13-7-10(8-14(20)18(13)24)5-6-21-15-9-16(22)11-3-1-2-4-12(11)17(15)23/h1-4,7-9,21,24H,5-6H2