2-chloranyl-5-[[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]benzoic acid

Systemtic Name: 2-chloranyl-5-[[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]benzoic acid Openeye Name: 2-chloro-5-[[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]benzoic acid CAS Name: 2-chloro-5-[[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]benzoic acid Traditional Name: 2-chloro-5-[[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl]amino]benzoic acid Formula: C22H30ClNO2 MolecularWeight: 375.9321

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCNC1=CC(=C(C=C1)Cl)C(=O)O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C\CC/C(=C\CNC1=CC(=C(C=C1)Cl)C(=O)O)/C)/C)C

InChI

InChI=1S/C22H30ClNO2/c1-16(2)7-5-8-17(3)9-6-10-18(4)13-14-24-19-11-12-21(23)20(15-19)22(25)26/h7,9,11-13,15,24H,5-6,8,10,14H2,1-4H3,(H,25,26)/b17-9-,18-13-