(4-methyl-3-nitro-phenyl)-pyrrolidin-1-yl-methanone

Systemtic Name: (4-methyl-3-nitro-phenyl)-pyrrolidin-1-yl-methanone Openeye Name: (4-methyl-3-nitro-phenyl)-pyrrolidin-1-yl-methanone CAS Name: (4-methyl-3-nitrophenyl)-(1-pyrrolidinyl)methanone IUPAC Name: (4-methyl-3-nitrophenyl)-pyrrolidin-1-ylmethanone Traditional Name: (4-methyl-3-nitro-phenyl)-pyrrolidino-methanone Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O3/c1-9-4-5-10(8-11(9)14(16)17)12(15)13-6-2-3-7-13/h4-5,8H,2-3,6-7H2,1H3