[(E)-(8-bromanyl-1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid

Systemtic Name: [(E)-(8-bromanyl-1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid Openeye Name: [(E)-(8-bromo-1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid CAS Name: [(E)-(8-bromo-1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid IUPAC Name: [(E)-(8-bromo-1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid Traditional Name: [(E)-(8-bromo-1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid Formula: C11H14BrN2O3P MolecularWeight: 333.118221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCNC(=CP(=O)(O)O)C2=C1C=C(C=C2)Br

Isomeric SMILES

CN1CCN/C(=C/P(=O)(O)O)/C2=C1C=C(C=C2)Br

InChI

InChI=1S/C11H14BrN2O3P/c1-14-5-4-13-10(7-18(15,16)17)9-3-2-8(12)6-11(9)14/h2-3,6-7,13H,4-5H2,1H3,(H2,15,16,17)/b10-7+