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

Systemtic Name: 2-[(2-chloranyl-4-nitro-phenyl)-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[2-chloro-N-(cyclopropylmethyl)-4-nitro-anilino]acetic acid CAS Name: 2-[2-chloro-N-(cyclopropylmethyl)-4-nitroanilino]acetic acid IUPAC Name: 2-[2-chloro-N-(cyclopropylmethyl)-4-nitroanilino]acetic acid Traditional Name: 2-[2-chloro-N-(cyclopropylmethyl)-4-nitro-anilino]acetic acid Formula: C12H13ClN2O4 MolecularWeight: 284.69562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC1CN(CC(=O)O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H13ClN2O4/c13-10-5-9(15(18)19)3-4-11(10)14(7-12(16)17)6-8-1-2-8/h3-5,8H,1-2,6-7H2,(H,16,17)