2-(1-hydroxyethyl)-5,6-dimethyl-3-phenylazanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(1-hydroxyethyl)-5,6-dimethyl-3-phenylazanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-anilino-3-(1-hydroxyethyl)-5,6-dimethyl-1,4-benzoquinone CAS Name: 2-anilino-3-(1-hydroxyethyl)-5,6-dimethylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-anilino-3-(1-hydroxyethyl)-5,6-dimethylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-anilino-3-(1-hydroxyethyl)-5,6-dimethyl-p-benzoquinone Formula: C16H17NO3 MolecularWeight: 271.31108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C(C)O)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C(C)O)NC2=CC=CC=C2)C

InChI

InChI=1S/C16H17NO3/c1-9-10(2)16(20)14(13(11(3)18)15(9)19)17-12-7-5-4-6-8-12/h4-8,11,17-18H,1-3H3