[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-propoxyphenyl)butanoate

Systemtic Name: [1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-propoxyphenyl)butanoate Openeye Name: [2-[(5-chloro-2-pyridyl)amino]-1-methyl-2-oxo-ethyl] 4-oxo-4-(4-propoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-propoxyphenyl)butanoic acid [1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(5-chloropyridin-2-yl)amino]-1-oxopropan-2-yl] 4-oxo-4-(4-propoxyphenyl)butanoate Traditional Name: 4-keto-4-(4-propoxyphenyl)butyric acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C21H23ClN2O5/c1-3-12-28-17-7-4-15(5-8-17)18(25)9-11-20(26)29-14(2)21(27)24-19-10-6-16(22)13-23-19/h4-8,10,13-14H,3,9,11-12H2,1-2H3,(H,23,24,27)