[2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-naphthalen-2-yloxyethanoate

Systemtic Name: [2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-naphthalen-2-yloxyethanoate Openeye Name: [2-(4,5-dimethyl-2-nitro-anilino)-2-oxo-ethyl] 2-(2-naphthyloxy)acetate CAS Name: 2-(2-naphthalenyloxy)acetic acid [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate Traditional Name: 2-(2-naphthoxy)acetic acid [2-(4,5-dimethyl-2-nitro-anilino)-2-keto-ethyl] ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)COC(=O)COC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)COC(=O)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H20N2O6/c1-14-9-19(20(24(27)28)10-15(14)2)23-21(25)12-30-22(26)13-29-18-8-7-16-5-3-4-6-17(16)11-18/h3-11H,12-13H2,1-2H3,(H,23,25)