methyl butanoate; methyl 4-(2-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carboxylate

Systemtic Name: methyl butanoate; methyl 4-(2-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carboxylate Openeye Name: methyl butanoate; methyl 4-(2-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carboxylate CAS Name: butanoic acid methyl ester; 4-(2-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carboxylic acid methyl ester IUPAC Name: methyl butanoate; methyl 4-(2-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carboxylate Traditional Name: butyric acid methyl ester; 4-(2-chlorophenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carboxylic acid methyl ester Formula: C19H26ClNO4 MolecularWeight: 367.86704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC.CC1=C(C(CCN1)C2=CC=CC=C2Cl)C(=O)OC

Isomeric SMILES

CCCC(=O)OC.CC1=C(C(CCN1)C2=CC=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C14H16ClNO2.C5H10O2/c1-9-13(14(17)18-2)11(7-8-16-9)10-5-3-4-6-12(10)15;1-3-4-5(6)7-2/h3-6,11,16H,7-8H2,1-2H3;3-4H2,1-2H3