2-[(2-methyl-5-nitro-phenyl)amino]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)amino]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(2-methyl-5-nitro-anilino)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-(2-methyl-5-nitroanilino)-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(2-methyl-5-nitroanilino)-1-pyrrolidin-1-ylethanone Traditional Name: 2-(2-methyl-5-nitro-anilino)-1-pyrrolidino-ethanone Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3/c1-10-4-5-11(16(18)19)8-12(10)14-9-13(17)15-6-2-3-7-15/h4-5,8,14H,2-3,6-7,9H2,1H3