(2-methyl-3,5-dinitro-phenyl)-pyrrolidin-1-yl-methanone

Systemtic Name: (2-methyl-3,5-dinitro-phenyl)-pyrrolidin-1-yl-methanone Openeye Name: (2-methyl-3,5-dinitro-phenyl)-pyrrolidin-1-yl-methanone CAS Name: (2-methyl-3,5-dinitrophenyl)-(1-pyrrolidinyl)methanone IUPAC Name: (2-methyl-3,5-dinitrophenyl)-pyrrolidin-1-ylmethanone Traditional Name: (2-methyl-3,5-dinitro-phenyl)-pyrrolidino-methanone Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)N2CCCC2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)N2CCCC2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O5/c1-8-10(12(16)13-4-2-3-5-13)6-9(14(17)18)7-11(8)15(19)20/h6-7H,2-5H2,1H3