2-[1-(4-chlorophenyl)ethylamino]-5-nitro-benzoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)ethylamino]-5-nitro-benzoic acid Openeye Name: 2-[1-(4-chlorophenyl)ethylamino]-5-nitro-benzoic acid CAS Name: 2-[1-(4-chlorophenyl)ethylamino]-5-nitrobenzoic acid IUPAC Name: 2-[1-(4-chlorophenyl)ethylamino]-5-nitrobenzoic acid Traditional Name: 2-[1-(4-chlorophenyl)ethylamino]-5-nitro-benzoic acid Formula: C15H13ClN2O4 MolecularWeight: 320.72772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Cl)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)Cl)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H13ClN2O4/c1-9(10-2-4-11(16)5-3-10)17-14-7-6-12(18(21)22)8-13(14)15(19)20/h2-9,17H,1H3,(H,19,20)