1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-prop-2-enyl-pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-prop-2-enyl-pyrazole-3-carboxamide Openeye Name: N-allyl-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-prop-2-enyl-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-prop-2-enylpyrazole-3-carboxamide Traditional Name: N-allyl-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C14H13ClN4O4 MolecularWeight: 336.73042

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN4O4/c1-2-6-16-14(20)12-5-7-18(17-12)9-23-13-4-3-10(19(21)22)8-11(13)15/h2-5,7-8H,1,6,9H2,(H,16,20)