2-[cyclopropylmethyl-(4-methoxy-2-nitro-phenyl)amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl-(4-methoxy-2-nitro-phenyl)amino]ethanoic acid Openeye Name: 2-[N-(cyclopropylmethyl)-4-methoxy-2-nitro-anilino]acetic acid CAS Name: 2-[N-(cyclopropylmethyl)-4-methoxy-2-nitroanilino]acetic acid IUPAC Name: 2-[N-(cyclopropylmethyl)-4-methoxy-2-nitroanilino]acetic acid Traditional Name: 2-[N-(cyclopropylmethyl)-4-methoxy-2-nitro-anilino]acetic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N(CC2CC2)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N(CC2CC2)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5/c1-20-10-4-5-11(12(6-10)15(18)19)14(8-13(16)17)7-9-2-3-9/h4-6,9H,2-3,7-8H2,1H3,(H,16,17)