4-[2-[(2R)-2-[(1Z,3E)-4,8-dimethylnona-1,3,7-trienyl]-5-oxidanylidene-pyrrolidin-1-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[(2R)-2-[(1Z,3E)-4,8-dimethylnona-1,3,7-trienyl]-5-oxidanylidene-pyrrolidin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[(2R)-2-[(1Z,3E)-4,8-dimethylnona-1,3,7-trienyl]-5-oxo-pyrrolidin-1-yl]ethyl]benzoic acid CAS Name: 4-[2-[(2R)-2-[(1Z,3E)-4,8-dimethylnona-1,3,7-trienyl]-5-oxo-1-pyrrolidinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[(2R)-2-[(1Z,3E)-4,8-dimethylnona-1,3,7-trienyl]-5-oxopyrrolidin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[(2R)-2-[(1Z,3E)-4,8-dimethylnona-1,3,7-trienyl]-5-keto-pyrrolidino]ethyl]benzoic acid Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC=CC1CCC(=O)N1CCC2=CC=C(C=C2)C(=O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C/C=C\[C@H]1CCC(=O)N1CCC2=CC=C(C=C2)C(=O)O)/C)C

InChI

InChI=1S/C24H31NO3/c1-18(2)6-4-7-19(3)8-5-9-22-14-15-23(26)25(22)17-16-20-10-12-21(13-11-20)24(27)28/h5-6,8-13,22H,4,7,14-17H2,1-3H3,(H,27,28)/b9-5-,19-8+/t22-/m0/s1