1-[4-(methylamino)-3-nitro-phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(methylamino)-3-nitro-phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(methylamino)-3-nitro-benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(methylamino)-3-nitrobenzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(methylamino)-3-nitro-benzoyl]proline Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCCC2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCCC2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c1-14-9-5-4-8(7-11(9)16(20)21)12(17)15-6-2-3-10(15)13(18)19/h4-5,7,10,14H,2-3,6H2,1H3,(H,18,19)