2-[4-butyl-1-[3-(2-methoxyphenoxy)-2-oxidanyl-propyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)propanamide

Systemtic Name: 2-[4-butyl-1-[3-(2-methoxyphenoxy)-2-oxidanyl-propyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)propanamide Openeye Name: 2-[4-butyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)propanamide CAS Name: 2-[4-butyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1-piperazin-1-iumyl]-N-(2,6-dimethylphenyl)propanamide IUPAC Name: 2-[4-butyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)propanamide Traditional Name: 2-[4-butyl-1-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)propionamide Formula: C29H44N3O4+ MolecularWeight: 498.67736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC[N+](CC1)(CC(COC2=CC=CC=C2OC)O)C(C)C(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCCCN1CC[N+](CC1)(CC(COC2=CC=CC=C2OC)O)C(C)C(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C29H43N3O4/c1-6-7-15-31-16-18-32(19-17-31,20-25(33)21-36-27-14-9-8-13-26(27)35-5)24(4)29(34)30-28-22(2)11-10-12-23(28)3/h8-14,24-25,33H,6-7,15-21H2,1-5H3/p+1