5-(4-methylphenyl)-1-(2-oxidanylidenehexyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 5-(4-methylphenyl)-1-(2-oxidanylidenehexyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(2-oxohexyl)-5-(p-tolyl)-3H-1,4-benzodiazepin-2-one CAS Name: 5-(4-methylphenyl)-1-(2-oxohexyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(4-methylphenyl)-1-(2-oxohexyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(2-ketohexyl)-5-(p-tolyl)-3H-1,4-benzodiazepin-2-one Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CN1C(=O)CN=C(C2=CC=CC=C21)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC(=O)CN1C(=O)CN=C(C2=CC=CC=C21)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O2/c1-3-4-7-18(25)15-24-20-9-6-5-8-19(20)22(23-14-21(24)26)17-12-10-16(2)11-13-17/h5-6,8-13H,3-4,7,14-15H2,1-2H3