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3-(10-phenylmethoxydecyl)-1-(phenylmethyl)pyridin-1-ium chloride

3-(10-phenylmethoxydecyl)-1-(phenylmethyl)pyridin-1-ium chloride

Systemtic Name:3-(10-phenylmethoxydecyl)-1-(phenylmethyl)pyridin-1-ium chloride
Openeye Name:1-benzyl-3-(10-benzyloxydecyl)pyridin-1-ium chloride
CAS Name:3-(10-phenylmethoxydecyl)-1-(phenylmethyl)pyridin-1-ium chloride
IUPAC Name:1-benzyl-3-(10-phenylmethoxydecyl)pyridin-1-ium chloride
Traditional Name:3-(10-benzoxydecyl)-1-benzyl-pyridin-1-ium chloride
Formula: C29H38ClNO
MolecularWeight: 452.07112
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)CCCCCCCCCCOCC3=CC=CC=C3.[Cl-]


Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)CCCCCCCCCCOCC3=CC=CC=C3.[Cl-]


InChI

InChI=1S/C29H38NO.ClH/c1(2-4-6-14-23-31-26-29-19-12-8-13-20-29)3-5-9-16-28-21-15-22-30(25-28)24-27-17-10-7-11-18-27;/h7-8,10-13,15,17-22,25H,1-6,9,14,16,23-24,26H2;1H/q+1;/p-1


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