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

Systemtic Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-benzaldehyde Openeye Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-benzaldehyde CAS Name: 3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-methoxybenzaldehyde IUPAC Name: 3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxybenzaldehyde Traditional Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-benzaldehyde Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=O)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=O)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O4/c1-9-14(17(19)20)10(2)16(15-9)7-12-6-11(8-18)4-5-13(12)21-3/h4-6,8H,7H2,1-3H3