N-[(1-ethylpyridin-1-ium-3-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzenesulfonamide

Systemtic Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzenesulfonamide Openeye Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzenesulfonamide CAS Name: N-[(1-ethyl-3-pyridin-1-iumyl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxyphenyl)methyl]benzenesulfonamide IUPAC Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxyphenyl)methyl]benzenesulfonamide Traditional Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-4-methyl-N-(2-methyl-4-myristyloxy-benzyl)benzenesulfonamide Formula: C37H55N2O3S+ MolecularWeight: 607.9092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=C[N+](=CC=C2)CC)S(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=C[N+](=CC=C2)CC)S(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C37H55N2O3S/c1-5-7-8-9-10-11-12-13-14-15-16-17-27-42-36-23-22-35(33(4)28-36)31-39(30-34-19-18-26-38(6-2)29-34)43(40,41)37-24-20-32(3)21-25-37/h18-26,28-29H,5-17,27,30-31H2,1-4H3/q+1