6-chloranyl-7-[2-(4-hydroxyphenyl)ethylamino]-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 6-chloranyl-7-[2-(4-hydroxyphenyl)ethylamino]-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 6-chloro-5,8-dihydroxy-7-[2-(4-hydroxyphenyl)ethylamino]naphthalene-1,4-dione CAS Name: 6-chloro-5,8-dihydroxy-7-[2-(4-hydroxyphenyl)ethylamino]naphthalene-1,4-dione IUPAC Name: 6-chloro-5,8-dihydroxy-7-[2-(4-hydroxyphenyl)ethylamino]naphthalene-1,4-dione Traditional Name: 6-chloro-5,8-dihydroxy-7-[2-(4-hydroxyphenyl)ethylamino]-1,4-naphthoquinone Formula: C18H14ClNO5 MolecularWeight: 359.76046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC2=C(C3=C(C(=O)C=CC3=O)C(=C2Cl)O)O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC2=C(C3=C(C(=O)C=CC3=O)C(=C2Cl)O)O)O

InChI

InChI=1S/C18H14ClNO5/c19-15-16(20-8-7-9-1-3-10(21)4-2-9)18(25)14-12(23)6-5-11(22)13(14)17(15)24/h1-6,20-21,24-25H,7-8H2