2-[1-[12-[4-(2-oxidanylpent-4-en-2-yl)pyridin-1-ium-1-yl]dodecyl]pyridin-1-ium-4-yl]pent-4-en-2-ol

Systemtic Name: 2-[1-[12-[4-(2-oxidanylpent-4-en-2-yl)pyridin-1-ium-1-yl]dodecyl]pyridin-1-ium-4-yl]pent-4-en-2-ol Openeye Name: 2-[1-[12-[4-(1-hydroxy-1-methyl-but-3-enyl)pyridin-1-ium-1-yl]dodecyl]pyridin-1-ium-4-yl]pent-4-en-2-ol CAS Name: 2-[1-[12-[4-(2-hydroxypent-4-en-2-yl)-1-pyridin-1-iumyl]dodecyl]-4-pyridin-1-iumyl]-4-penten-2-ol IUPAC Name: 2-[1-[12-[4-(2-hydroxypent-4-en-2-yl)pyridin-1-ium-1-yl]dodecyl]pyridin-1-ium-4-yl]pent-4-en-2-ol Traditional Name: 2-[1-[12-[4-(1-hydroxy-1-methyl-but-3-enyl)pyridin-1-ium-1-yl]dodecyl]pyridin-1-ium-4-yl]pent-4-en-2-ol Formula: C32H50N2O2+2 MolecularWeight: 494.7516

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C)(C1=CC=[N+](C=C1)CCCCCCCCCCCC[N+]2=CC=C(C=C2)C(C)(CC=C)O)O

Isomeric SMILES

CC(CC=C)(C1=CC=[N+](C=C1)CCCCCCCCCCCC[N+]2=CC=C(C=C2)C(C)(CC=C)O)O

InChI

InChI=1S/C32H50N2O2/c1-5-21-31(3,35)29-17-25-33(26-18-29)23-15-13-11-9-7-8-10-12-14-16-24-34-27-19-30(20-28-34)32(4,36)22-6-2/h5-6,17-20,25-28,35-36H,1-2,7-16,21-24H2,3-4H3/q+2