5-(3-hexyl-1-phenyl-6,7-dihydro-5H-pyrrolizin-2-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(3-hexyl-1-phenyl-6,7-dihydro-5H-pyrrolizin-2-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3-hexyl-1-phenyl-6,7-dihydro-5H-pyrrolizin-2-yl)-5-oxo-pentanoic acid CAS Name: 5-(3-hexyl-1-phenyl-6,7-dihydro-5H-pyrrolizin-2-yl)-5-oxopentanoic acid IUPAC Name: 5-(3-hexyl-1-phenyl-6,7-dihydro-5H-pyrrolizin-2-yl)-5-oxopentanoic acid Traditional Name: 5-(3-hexyl-1-phenyl-6,7-dihydro-5H-pyrrolizin-2-yl)-5-keto-valeric acid Formula: C24H31NO3 MolecularWeight: 381.50784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C2N1CCC2)C3=CC=CC=C3)C(=O)CCCC(=O)O

Isomeric SMILES

CCCCCCC1=C(C(=C2N1CCC2)C3=CC=CC=C3)C(=O)CCCC(=O)O

InChI

InChI=1S/C24H31NO3/c1-2-3-4-8-13-20-24(21(26)15-9-16-22(27)28)23(18-11-6-5-7-12-18)19-14-10-17-25(19)20/h5-7,11-12H,2-4,8-10,13-17H2,1H3,(H,27,28)