2-nitro-5-[[4-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]phenolate

Systemtic Name: 2-nitro-5-[[4-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]phenolate Openeye Name: 2-nitro-5-[[4-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]phenolate CAS Name: 2-nitro-5-[oxo-[[4-(1-pyrazolylmethyl)phenyl]methylamino]methyl]phenolate IUPAC Name: 2-nitro-5-[[4-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]phenolate Traditional Name: 2-nitro-5-[[4-(pyrazol-1-ylmethyl)benzyl]carbamoyl]phenolate Formula: C18H15N4O4- MolecularWeight: 351.3361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O4/c23-17-10-15(6-7-16(17)22(25)26)18(24)19-11-13-2-4-14(5-3-13)12-21-9-1-8-20-21/h1-10,23H,11-12H2,(H,19,24)/p-1