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

Systemtic Name: 4-[2-(2-methoxy-5-methyl-phenyl)-2-oxidanylidene-ethyl]-2-propyl-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[2-(2-methoxy-5-methyl-phenyl)-2-oxo-ethyl]-2-propyl-1,4-benzoxazepine-3,5-dione CAS Name: 4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[2-keto-2-(2-methoxy-5-methyl-phenyl)ethyl]-2-propyl-1,4-benzoxazepine-3,5-quinone Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C22H23NO5/c1-4-7-20-22(26)23(21(25)15-8-5-6-9-19(15)28-20)13-17(24)16-12-14(2)10-11-18(16)27-3/h5-6,8-12,20H,4,7,13H2,1-3H3