[(S)-(1,3-diphenylpyrazol-4-yl)-phosphonato-methyl]-(phenylmethyl)azanium

Systemtic Name: [(S)-(1,3-diphenylpyrazol-4-yl)-phosphonato-methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(S)-(1,3-diphenylpyrazol-4-yl)-phosphonato-methyl]ammonium CAS Name: [(S)-(1,3-diphenyl-4-pyrazolyl)-phosphonatomethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(S)-(1,3-diphenylpyrazol-4-yl)-phosphonatomethyl]azanium Traditional Name: benzyl-[(S)-(1,3-diphenylpyrazol-4-yl)-phosphonato-methyl]ammonium Formula: C23H21N3O3P- MolecularWeight: 418.404901

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C(C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)P(=O)([O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+][C@H](C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)P(=O)([O-])[O-]

InChI

InChI=1S/C23H22N3O3P/c27-30(28,29)23(24-16-18-10-4-1-5-11-18)21-17-26(20-14-8-3-9-15-20)25-22(21)19-12-6-2-7-13-19/h1-15,17,23-24H,16H2,(H2,27,28,29)/p-1/t23-/m0/s1