7-bromanyl-N,5-dimethyl-4-oxidanyl-3H-1,4-benzodiazepin-2-imine

Systemtic Name: 7-bromanyl-N,5-dimethyl-4-oxidanyl-3H-1,4-benzodiazepin-2-imine Openeye Name: 7-bromo-4-hydroxy-N,5-dimethyl-3H-1,4-benzodiazepin-2-imine CAS Name: 7-bromo-4-hydroxy-N,5-dimethyl-3H-1,4-benzodiazepin-2-imine IUPAC Name: 7-bromo-4-hydroxy-N,5-dimethyl-3H-1,4-benzodiazepin-2-imine Traditional Name: (7-bromo-4-hydroxy-5-methyl-3H-1,4-benzodiazepin-2-ylidene)-methyl-amine Formula: C11H12BrN3O MolecularWeight: 282.13648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NC(=NC)CN1O)Br

Isomeric SMILES

CC1=C2C=C(C=CC2=NC(=NC)CN1O)Br

InChI

InChI=1S/C11H12BrN3O/c1-7-9-5-8(12)3-4-10(9)14-11(13-2)6-15(7)16/h3-5,16H,6H2,1-2H3