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

Systemtic Name: 1-(2-oxidanylidenehexyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(2-oxohexyl)-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 1-(2-oxohexyl)-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-(2-oxohexyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(2-ketohexyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2/c1-2-3-11-17(24)15-23-19-13-8-7-12-18(19)21(22-14-20(23)25)16-9-5-4-6-10-16/h4-10,12-13H,2-3,11,14-15H2,1H3