5-[2-(4-ethanoyl-2-methoxy-phenoxy)ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-(4-ethanoyl-2-methoxy-phenoxy)ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(4-acetyl-2-methoxy-phenoxy)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-(4-acetyl-2-methoxyphenoxy)-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-(4-acetyl-2-methoxy-phenoxy)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)C(=O)C)OC

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)C(=O)C)OC

InChI

InChI=1S/C21H22N2O5/c1-13-10-20(25)22-16-6-4-5-7-17(16)23(13)21(26)12-28-18-9-8-15(14(2)24)11-19(18)27-3/h4-9,11,13H,10,12H2,1-3H3,(H,22,25)