[1-[[3,5-bis(chloranyl)pyridin-2-yl]amino]-1-oxidanylidene-propan-2-yl] 2-benzamido-3-methyl-butanoate

Systemtic Name: [1-[[3,5-bis(chloranyl)pyridin-2-yl]amino]-1-oxidanylidene-propan-2-yl] 2-benzamido-3-methyl-butanoate Openeye Name: [2-[(3,5-dichloro-2-pyridyl)amino]-1-methyl-2-oxo-ethyl] 2-benzamido-3-methyl-butanoate CAS Name: 2-benzamido-3-methylbutanoic acid [1-[(3,5-dichloro-2-pyridinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3,5-dichloropyridin-2-yl)amino]-1-oxopropan-2-yl] 2-benzamido-3-methylbutanoate Traditional Name: 2-benzamido-3-methyl-butyric acid [2-[(3,5-dichloro-2-pyridyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C20H21Cl2N3O4 MolecularWeight: 438.30444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)NC1=C(C=C(C=N1)Cl)Cl)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)OC(C)C(=O)NC1=C(C=C(C=N1)Cl)Cl)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21Cl2N3O4/c1-11(2)16(24-19(27)13-7-5-4-6-8-13)20(28)29-12(3)18(26)25-17-15(22)9-14(21)10-23-17/h4-12,16H,1-3H3,(H,24,27)(H,23,25,26)