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

Systemtic Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-nitro-benzaldehyde Openeye Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-nitro-benzaldehyde CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]-3-nitrobenzaldehyde IUPAC Name: 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]-3-nitrobenzaldehyde Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-3-nitro-benzaldehyde Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O3/c1-14-18(15(2)23(21-14)17-7-5-4-6-8-17)12-22(3)19-10-9-16(13-25)11-20(19)24(26)27/h4-11,13H,12H2,1-3H3