N-[(4-dodecoxyphenyl)methyl]-N-[4-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]propanamide

Systemtic Name: N-[(4-dodecoxyphenyl)methyl]-N-[4-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]propanamide Openeye Name: N-[(4-dodecoxyphenyl)methyl]-N-[4-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]propanamide CAS Name: N-[(4-dodecoxyphenyl)methyl]-N-[4-[(5-methyl-3-thiazol-3-iumyl)methyl]phenyl]propanamide IUPAC Name: N-[(4-dodecoxyphenyl)methyl]-N-[4-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]propanamide Traditional Name: N-(4-lauryloxybenzyl)-N-[4-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]propionamide Formula: C33H47N2O2S+ MolecularWeight: 535.80348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C[N+]3=CSC(=C3)C)C(=O)CC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C[N+]3=CSC(=C3)C)C(=O)CC

InChI

InChI=1S/C33H47N2O2S/c1-4-6-7-8-9-10-11-12-13-14-23-37-32-21-17-30(18-22-32)26-35(33(36)5-2)31-19-15-29(16-20-31)25-34-24-28(3)38-27-34/h15-22,24,27H,4-14,23,25-26H2,1-3H3/q+1