3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-dione hydrochloride

Systemtic Name: 3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-dione hydrochloride Openeye Name: 3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-dione hydrochloride CAS Name: 3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-dione hydrochloride IUPAC Name: 3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-dione hydrochloride Traditional Name: 3-(2-hydroxyethyl)-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-quinone hydrochloride Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C2=CC(=O)C(=O)C=C21)C3=CC=CC=C3)CCO.Cl

Isomeric SMILES

C1CN(CC(C2=CC(=O)C(=O)C=C21)C3=CC=CC=C3)CCO.Cl

InChI

InChI=1S/C18H19NO3.ClH/c20-9-8-19-7-6-14-10-17(21)18(22)11-15(14)16(12-19)13-4-2-1-3-5-13;/h1-5,10-11,16,20H,6-9,12H2;1H