5-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]carbamoyl]-2-nitro-phenolate

Systemtic Name: 5-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]carbamoyl]-2-nitro-phenolate Openeye Name: 5-[(1-benzylpyrazol-4-yl)methyl-methyl-carbamoyl]-2-nitro-phenolate CAS Name: 5-[[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[(1-benzylpyrazol-4-yl)methyl-methylcarbamoyl]-2-nitrophenolate Traditional Name: 5-[(1-benzylpyrazol-4-yl)methyl-methyl-carbamoyl]-2-nitro-phenolate Formula: C19H17N4O4- MolecularWeight: 365.36268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H18N4O4/c1-21(19(25)16-7-8-17(23(26)27)18(24)9-16)11-15-10-20-22(13-15)12-14-5-3-2-4-6-14/h2-10,13,24H,11-12H2,1H3/p-1