2-(2-ethyl-6-methyl-phenyl)-4-[(2-hydroxyethylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(2-ethyl-6-methyl-phenyl)-4-[(2-hydroxyethylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(2-ethyl-6-methyl-phenyl)-4-[(2-hydroxyethylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(2-ethyl-6-methylphenyl)-4-[(2-hydroxyethylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(2-ethyl-6-methylphenyl)-4-[(2-hydroxyethylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(2-ethyl-6-methyl-phenyl)-4-[(2-hydroxyethylamino)methylene]isoquinoline-1,3-quinone Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N2C(=O)C3=CC=CC=C3C(=CNCCO)C2=O)C

Isomeric SMILES

CCC1=CC=CC(=C1N2C(=O)C3=CC=CC=C3C(=CNCCO)C2=O)C

InChI

InChI=1S/C21H22N2O3/c1-3-15-8-6-7-14(2)19(15)23-20(25)17-10-5-4-9-16(17)18(21(23)26)13-22-11-12-24/h4-10,13,22,24H,3,11-12H2,1-2H3