6-butyl-5-(3-chloranylfuran-2-yl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 6-butyl-5-(3-chloranylfuran-2-yl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 6-butyl-5-(3-chlorofuran-2-carbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 6-butyl-5-[(3-chloro-2-furanyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 6-butyl-5-(3-chlorofuran-2-carbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 6-butyl-5-(3-chloro-2-furoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=C(C=CO3)Cl

Isomeric SMILES

CCCCC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=C(C=CO3)Cl

InChI

InChI=1S/C17H18ClNO4/c1-2-3-4-10-9-13-11(17(21)22)5-7-19(13)14(10)15(20)16-12(18)6-8-23-16/h6,8-9,11H,2-5,7H2,1H3,(H,21,22)