(3E)-3-[(4-ethoxyphenyl)-oxidanyl-methylidene]isoquinoline-1,4-dione

Systemtic Name: (3E)-3-[(4-ethoxyphenyl)-oxidanyl-methylidene]isoquinoline-1,4-dione Openeye Name: (3E)-3-[(4-ethoxyphenyl)-hydroxy-methylene]isoquinoline-1,4-dione CAS Name: (3E)-3-[(4-ethoxyphenyl)-hydroxymethylidene]isoquinoline-1,4-dione IUPAC Name: (3E)-3-[(4-ethoxyphenyl)-hydroxymethylidene]isoquinoline-1,4-dione Traditional Name: (3E)-3-[hydroxy(p-phenetyl)methylene]isoquinoline-1,4-quinone Formula: C18H15NO4 MolecularWeight: 309.316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=C2C(=O)C3=CC=CC=C3C(=O)N2)O

Isomeric SMILES

CCOC1=CC=C(C=C1)/C(=C\2/C(=O)C3=CC=CC=C3C(=O)N2)/O

InChI

InChI=1S/C18H15NO4/c1-2-23-12-9-7-11(8-10-12)16(20)15-17(21)13-5-3-4-6-14(13)18(22)19-15/h3-10,20H,2H2,1H3,(H,19,22)/b16-15+