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

Systemtic Name: 5-(3-butylphenyl)carbonyl-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(3-butylbenzoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(3-butylphenyl)-oxomethyl]-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(3-butylbenzoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(3-butylbenzoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO3/c1-3-4-6-14-7-5-8-15(12-14)19(22)18-13(2)11-17-16(20(23)24)9-10-21(17)18/h5,7-8,11-12,16H,3-4,6,9-10H2,1-2H3,(H,23,24)