2-[[1-(2,4-dinitrophenyl)pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[1-(2,4-dinitrophenyl)pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[1-(2,4-dinitrophenyl)pyrrolidine-2-carbonyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[1-(2,4-dinitrophenyl)-2-pyrrolidinyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[1-(2,4-dinitrophenyl)pyrrolidine-2-carbonyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[1-(2,4-dinitrophenyl)prolyl]amino]-4-methyl-valeric acid Formula: C17H22N4O7 MolecularWeight: 394.37918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C1CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O7/c1-10(2)8-12(17(23)24)18-16(22)14-4-3-7-19(14)13-6-5-11(20(25)26)9-15(13)21(27)28/h5-6,9-10,12,14H,3-4,7-8H2,1-2H3,(H,18,22)(H,23,24)