2-(1-dodecyl-1,2,2,6,6-pentamethyl-piperidin-1-ium-4-ylidene)ethanoic acid

Systemtic Name: 2-(1-dodecyl-1,2,2,6,6-pentamethyl-piperidin-1-ium-4-ylidene)ethanoic acid Openeye Name: 2-(1-dodecyl-1,2,2,6,6-pentamethyl-piperidin-1-ium-4-ylidene)acetic acid CAS Name: 2-(1-dodecyl-1,2,2,6,6-pentamethyl-4-piperidin-1-iumylidene)acetic acid IUPAC Name: 2-(1-dodecyl-1,2,2,6,6-pentamethylpiperidin-1-ium-4-ylidene)acetic acid Traditional Name: 2-(1-lauryl-1,2,2,6,6-pentamethyl-piperidin-1-ium-4-ylidene)acetic acid Formula: C24H46NO2+ MolecularWeight: 380.62754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1(C(CC(=CC(=O)O)CC1(C)C)(C)C)C

Isomeric SMILES

CCCCCCCCCCCC[N+]1(C(CC(=CC(=O)O)CC1(C)C)(C)C)C

InChI

InChI=1S/C24H45NO2/c1-7-8-9-10-11-12-13-14-15-16-17-25(6)23(2,3)19-21(18-22(26)27)20-24(25,4)5/h18H,7-17,19-20H2,1-6H3/p+1