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

Systemtic Name: 5-[1-(2-bromophenyl)ethylamino]-2-nitro-benzoic acid Openeye Name: 5-[1-(2-bromophenyl)ethylamino]-2-nitro-benzoic acid CAS Name: 5-[1-(2-bromophenyl)ethylamino]-2-nitrobenzoic acid IUPAC Name: 5-[1-(2-bromophenyl)ethylamino]-2-nitrobenzoic acid Traditional Name: 5-[1-(2-bromophenyl)ethylamino]-2-nitro-benzoic acid Formula: C15H13BrN2O4 MolecularWeight: 365.17872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1Br)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H13BrN2O4/c1-9(11-4-2-3-5-13(11)16)17-10-6-7-14(18(21)22)12(8-10)15(19)20/h2-9,17H,1H3,(H,19,20)