docosyl-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propyl]-dimethyl-azanium

Systemtic Name: docosyl-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propyl]-dimethyl-azanium Openeye Name: docosyl-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propyl]-dimethyl-ammonium CAS Name: docosyl-[3-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]propyl]-dimethylammonium IUPAC Name: docosyl-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propyl]-dimethylazanium Traditional Name: behenyl-[3-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]propyl]-dimethyl-ammonium Formula: C37H67N2O2+ MolecularWeight: 571.94008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)C=CC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)/C=C/C1=CC=C(C=C1)OC

InChI

InChI=1S/C37H66N2O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-33-39(2,3)34-25-32-38-37(40)31-28-35-26-29-36(41-4)30-27-35/h26-31H,5-25,32-34H2,1-4H3/p+1/b31-28+