2-ethyl-4-[2-(2-methoxy-5-methyl-phenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 2-ethyl-4-[2-(2-methoxy-5-methyl-phenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 2-ethyl-4-[2-(2-methoxy-5-methyl-phenyl)-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 2-ethyl-4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 2-ethyl-4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 2-ethyl-4-[2-keto-2-(2-methoxy-5-methyl-phenyl)ethyl]-1,4-benzoxazepine-3,5-quinone Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C21H21NO5/c1-4-17-21(25)22(20(24)14-7-5-6-8-19(14)27-17)12-16(23)15-11-13(2)9-10-18(15)26-3/h5-11,17H,4,12H2,1-3H3