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

Systemtic Name: [(E)-(1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid Openeye Name: [(E)-(1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid CAS Name: [(E)-(1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid IUPAC Name: [(E)-(1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid Traditional Name: [(E)-(1-methyl-3,4-dihydro-2H-1,4-benzodiazepin-5-ylidene)methyl]phosphonic acid Formula: C11H15N2O3P MolecularWeight: 254.222161

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNC(=CP(=O)(O)O)C2=CC=CC=C21

Isomeric SMILES

CN1CCN/C(=C/P(=O)(O)O)/C2=CC=CC=C21

InChI

InChI=1S/C11H15N2O3P/c1-13-7-6-12-10(8-17(14,15)16)9-4-2-3-5-11(9)13/h2-5,8,12H,6-7H2,1H3,(H2,14,15,16)/b10-8+