N-[2-(4-hexanoylpiperazin-1-ium-1-yl)ethyl]-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]ethanamide

Systemtic Name: N-[2-(4-hexanoylpiperazin-1-ium-1-yl)ethyl]-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]ethanamide Openeye Name: N-[2-(4-hexanoylpiperazin-1-ium-1-yl)ethyl]-N-[(E)-3-(2-methoxyphenyl)allyl]acetamide CAS Name: N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-N-[2-[4-(1-oxohexyl)-1-piperazin-1-iumyl]ethyl]acetamide IUPAC Name: N-[2-(4-hexanoylpiperazin-1-ium-1-yl)ethyl]-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]acetamide Traditional Name: N-[2-(4-caproylpiperazin-1-ium-1-yl)ethyl]-N-[(E)-3-(2-methoxyphenyl)allyl]acetamide Formula: C24H38N3O3+ MolecularWeight: 416.57682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CC[NH+](CC1)CCN(CC=CC2=CC=CC=C2OC)C(=O)C

Isomeric SMILES

CCCCCC(=O)N1CC[NH+](CC1)CCN(C/C=C/C2=CC=CC=C2OC)C(=O)C

InChI

InChI=1S/C24H37N3O3/c1-4-5-6-13-24(29)27-19-16-25(17-20-27)15-18-26(21(2)28)14-9-11-22-10-7-8-12-23(22)30-3/h7-12H,4-6,13-20H2,1-3H3/p+1/b11-9+