1-[4-(butylamino)-3-methanoyl-pyridin-2-yl]oxypropan-2-yl 4-chloranylbenzoate

Systemtic Name: 1-[4-(butylamino)-3-methanoyl-pyridin-2-yl]oxypropan-2-yl 4-chloranylbenzoate Openeye Name: [2-[[4-(butylamino)-3-formyl-2-pyridyl]oxy]-1-methyl-ethyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid 1-[[4-(butylamino)-3-formyl-2-pyridinyl]oxy]propan-2-yl ester IUPAC Name: 1-[4-(butylamino)-3-formylpyridin-2-yl]oxypropan-2-yl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-[[4-(butylamino)-3-formyl-2-pyridyl]oxy]-1-methyl-ethyl] ester Formula: C20H23ClN2O4 MolecularWeight: 390.86062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC=C1)OCC(C)OC(=O)C2=CC=C(C=C2)Cl)C=O

Isomeric SMILES

CCCCNC1=C(C(=NC=C1)OCC(C)OC(=O)C2=CC=C(C=C2)Cl)C=O

InChI

InChI=1S/C20H23ClN2O4/c1-3-4-10-22-18-9-11-23-19(17(18)12-24)26-13-14(2)27-20(25)15-5-7-16(21)8-6-15/h5-9,11-12,14H,3-4,10,13H2,1-2H3,(H,22,23)