[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-[4-(dimethylamino)anilino]-2-oxo-ethyl] 2-[(2-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-[4-(dimethylamino)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(dimethylamino)anilino]-2-oxoethyl] 2-[(2-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-fluorobenzoyl)amino]-3-methyl-butyric acid [2-[4-(dimethylamino)anilino]-2-keto-ethyl] ester Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=CC=C(C=C1)N(C)C)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)NC1=CC=C(C=C1)N(C)C)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C22H26FN3O4/c1-14(2)20(25-21(28)17-7-5-6-8-18(17)23)22(29)30-13-19(27)24-15-9-11-16(12-10-15)26(3)4/h5-12,14,20H,13H2,1-4H3,(H,24,27)(H,25,28)