[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 3-fluoranyl-4-methyl-benzoate

Systemtic Name: [2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 3-fluoranyl-4-methyl-benzoate Openeye Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl] 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid [2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl] ester Formula: C18H18FN3O5 MolecularWeight: 375.351023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C18H18FN3O5/c1-12-2-3-13(10-16(12)19)18(24)27-11-17(23)21-9-8-20-14-4-6-15(7-5-14)22(25)26/h2-7,10,20H,8-9,11H2,1H3,(H,21,23)