(1,3-diphenylpyrazol-4-yl)methyl-[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-[(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-[(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-[(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: [(1R)-2-(carbomethoxyamino)-2-keto-1-methyl-ethyl]-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)OC)[NH+](C)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC(=O)OC)[NH+](C)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4O3/c1-16(21(27)23-22(28)29-3)25(2)14-18-15-26(19-12-8-5-9-13-19)24-20(18)17-10-6-4-7-11-17/h4-13,15-16H,14H2,1-3H3,(H,23,27,28)/p+1/t16-/m1/s1