2-[carboxy-[2-(4-nitrophenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(4-nitrophenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-(4-nitrophenyl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(4-nitrophenyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(4-nitrophenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-(4-nitrophenyl)ethyl]amino]-4-methyl-valeric acid Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H20N2O6/c1-10(2)9-13(14(18)19)16(15(20)21)8-7-11-3-5-12(6-4-11)17(22)23/h3-6,10,13H,7-9H2,1-2H3,(H,18,19)(H,20,21)