methyl 2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-5-nitro-benzoate

Systemtic Name: methyl 2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-5-nitro-benzoate Openeye Name: methyl 2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-5-nitro-benzoate CAS Name: 2-[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-5-nitrobenzoate Traditional Name: 2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-5-nitro-benzoic acid methyl ester Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN1C=C(C=N1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H16N4O4/c1-16(8-10-7-15-17(2)9-10)13-5-4-11(18(20)21)6-12(13)14(19)22-3/h4-7,9H,8H2,1-3H3