1-[[3-[(3-hexadecoxy-2-methoxy-propoxy)methyl]phenyl]methyl]-3-methyl-pyridin-1-ium

Systemtic Name: 1-[[3-[(3-hexadecoxy-2-methoxy-propoxy)methyl]phenyl]methyl]-3-methyl-pyridin-1-ium Openeye Name: 1-[[3-[(3-hexadecoxy-2-methoxy-propoxy)methyl]phenyl]methyl]-3-methyl-pyridin-1-ium CAS Name: 1-[[3-[(3-hexadecoxy-2-methoxypropoxy)methyl]phenyl]methyl]-3-methylpyridin-1-ium IUPAC Name: 1-[[3-[(3-hexadecoxy-2-methoxypropoxy)methyl]phenyl]methyl]-3-methylpyridin-1-ium Traditional Name: 1-[3-[(3-cetyloxy-2-methoxy-propoxy)methyl]benzyl]-3-methyl-pyridin-1-ium Formula: C34H56NO3+ MolecularWeight: 526.81334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COCC1=CC=CC(=C1)C[N+]2=CC=CC(=C2)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COCC1=CC=CC(=C1)C[N+]2=CC=CC(=C2)C)OC

InChI

InChI=1S/C34H56NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-37-29-34(36-3)30-38-28-33-22-18-21-32(25-33)27-35-23-19-20-31(2)26-35/h18-23,25-26,34H,4-17,24,27-30H2,1-3H3/q+1