[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] 2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-(4-bromo-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl] 2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: 2-(2-furoylamino)-3-methyl-butyric acid [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester Formula: C19H21BrN2O5 MolecularWeight: 437.28444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CO2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CO2)Br

InChI

InChI=1S/C19H21BrN2O5/c1-11(2)17(22-18(24)15-5-4-8-26-15)19(25)27-10-16(23)21-13-6-7-14(20)12(3)9-13/h4-9,11,17H,10H2,1-3H3,(H,21,23)(H,22,24)