N-[1-(4-methoxyphenyl)ethyl]-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-[1-(4-methoxyphenyl)ethyl]-4-methyl-3,5-dinitro-benzamide Openeye Name: N-[1-(4-methoxyphenyl)ethyl]-4-methyl-3,5-dinitro-benzamide CAS Name: N-[1-(4-methoxyphenyl)ethyl]-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-[1-(4-methoxyphenyl)ethyl]-4-methyl-3,5-dinitrobenzamide Traditional Name: N-[1-(4-methoxyphenyl)ethyl]-4-methyl-3,5-dinitro-benzamide Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC(C)C2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC(C)C2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-10-15(19(22)23)8-13(9-16(10)20(24)25)17(21)18-11(2)12-4-6-14(26-3)7-5-12/h4-9,11H,1-3H3,(H,18,21)