5-(2-ethylphenyl)sulfanyl-2,3-dimethoxy-naphthalene-1,4-dione

Systemtic Name: 5-(2-ethylphenyl)sulfanyl-2,3-dimethoxy-naphthalene-1,4-dione Openeye Name: 5-(2-ethylphenyl)sulfanyl-2,3-dimethoxy-naphthalene-1,4-dione CAS Name: 5-[(2-ethylphenyl)thio]-2,3-dimethoxynaphthalene-1,4-dione IUPAC Name: 5-(2-ethylphenyl)sulfanyl-2,3-dimethoxynaphthalene-1,4-dione Traditional Name: 5-[(2-ethylphenyl)thio]-2,3-dimethoxy-1,4-naphthoquinone Formula: C20H18O4S MolecularWeight: 354.41952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1SC2=CC=CC3=C2C(=O)C(=C(C3=O)OC)OC

Isomeric SMILES

CCC1=CC=CC=C1SC2=CC=CC3=C2C(=O)C(=C(C3=O)OC)OC

InChI

InChI=1S/C20H18O4S/c1-4-12-8-5-6-10-14(12)25-15-11-7-9-13-16(15)18(22)20(24-3)19(23-2)17(13)21/h5-11H,4H2,1-3H3