7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-(trideuteriomethyl)-3,4-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-(trideuteriomethyl)-3,4-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-(trideuteriomethyl)-3,4-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-1-(trideuteriomethyl)-3,4-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-(trideuteriomethyl)-3,4-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-1-(trideuteriomethyl)-3,4-dihydro-1,4-benzodiazepin-2-one Formula: C16H13ClN2O2 MolecularWeight: 304.75076

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CNC(=C2C=CC(=O)C=C2)C3=C1C=CC(=C3)Cl

Isomeric SMILES

[2H][13C]([2H])([2H])N1C(=O)CNC(=C2C=CC(=O)C=C2)C3=C1C=CC(=C3)Cl

InChI

InChI=1S/C16H13ClN2O2/c1-19-14-7-4-11(17)8-13(14)16(18-9-15(19)21)10-2-5-12(20)6-3-10/h2-8,18H,9H2,1H3/i1+1D3