2-butyl-3-(3-chloranylfuran-2-yl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid

Systemtic Name: 2-butyl-3-(3-chloranylfuran-2-yl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid Openeye Name: 2-butyl-3-(3-chlorofuran-2-carbonyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid CAS Name: 2-butyl-3-[(3-chloro-2-furanyl)-oxomethyl]-5,6,7,8-tetrahydroindolizine-8-carboxylic acid IUPAC Name: 2-butyl-3-(3-chlorofuran-2-carbonyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid Traditional Name: 2-butyl-3-(3-chloro-2-furoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2CCCC(C2=C1)C(=O)O)C(=O)C3=C(C=CO3)Cl

Isomeric SMILES

CCCCC1=C(N2CCCC(C2=C1)C(=O)O)C(=O)C3=C(C=CO3)Cl

InChI

InChI=1S/C18H20ClNO4/c1-2-3-5-11-10-14-12(18(22)23)6-4-8-20(14)15(11)16(21)17-13(19)7-9-24-17/h7,9-10,12H,2-6,8H2,1H3,(H,22,23)