N-[2-(4-methoxyphenyl)ethyl]-2,4-dinitro-benzamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-2,4-dinitro-benzamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-2,4-dinitro-benzamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-2,4-dinitrobenzamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-2,4-dinitrobenzamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-2,4-dinitro-benzamide Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O6/c1-25-13-5-2-11(3-6-13)8-9-17-16(20)14-7-4-12(18(21)22)10-15(14)19(23)24/h2-7,10H,8-9H2,1H3,(H,17,20)