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

Systemtic Name: 5-(4-bromophenyl)carbonyl-6-butyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-bromobenzoyl)-6-butyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(4-bromophenyl)-oxomethyl]-6-butyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-bromobenzoyl)-6-butyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(4-bromobenzoyl)-6-butyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H20BrNO3/c1-2-3-4-13-11-16-15(19(23)24)9-10-21(16)17(13)18(22)12-5-7-14(20)8-6-12/h5-8,11,15H,2-4,9-10H2,1H3,(H,23,24)