[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(1-bromanylnaphthalen-2-yl)oxyethanoate

Systemtic Name: [2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(1-bromanylnaphthalen-2-yl)oxyethanoate Openeye Name: [2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl] 2-[(1-bromo-2-naphthyl)oxy]acetate CAS Name: 2-[(1-bromo-2-naphthalenyl)oxy]acetic acid [2-(2-methyl-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-5-nitroanilino)-2-oxoethyl] 2-(1-bromonaphthalen-2-yl)oxyacetate Traditional Name: 2-(1-bromo-2-naphthoxy)acetic acid [2-keto-2-(2-methyl-5-nitro-anilino)ethyl] ester Formula: C21H17BrN2O6 MolecularWeight: 473.27348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C21H17BrN2O6/c1-13-6-8-15(24(27)28)10-17(13)23-19(25)11-30-20(26)12-29-18-9-7-14-4-2-3-5-16(14)21(18)22/h2-10H,11-12H2,1H3,(H,23,25)