5-(4-butylphenyl)carbonyl-6-chloranyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 5-(4-butylphenyl)carbonyl-6-chloranyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-butylbenzoyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(4-butylphenyl)-oxomethyl]-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-butylbenzoyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(4-butylbenzoyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C19H20ClNO3 MolecularWeight: 345.82

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)O)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)O)Cl

InChI

InChI=1S/C19H20ClNO3/c1-2-3-4-12-5-7-13(8-6-12)18(22)17-15(20)11-16-14(19(23)24)9-10-21(16)17/h5-8,11,14H,2-4,9-10H2,1H3,(H,23,24)