4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-nitro-benzaldehyde

Systemtic Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-nitro-benzaldehyde Openeye Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-nitro-benzaldehyde CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylamino]-3-nitrobenzaldehyde IUPAC Name: 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylamino]-3-nitrobenzaldehyde Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-nitro-benzaldehyde Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3/c1-13-17(14(2)22(21-13)16-6-4-3-5-7-16)11-20-18-9-8-15(12-24)10-19(18)23(25)26/h3-10,12,20H,11H2,1-2H3