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carboxymethyl-dodecyl-(2-hydroxyethyl)-(1-phenylprop-2-enyl)azanium

carboxymethyl-dodecyl-(2-hydroxyethyl)-(1-phenylprop-2-enyl)azanium

Systemtic Name:carboxymethyl-dodecyl-(2-hydroxyethyl)-(1-phenylprop-2-enyl)azanium
Openeye Name:carboxymethyl-dodecyl-(2-hydroxyethyl)-(1-phenylallyl)ammonium
CAS Name:carboxymethyl-dodecyl-(2-hydroxyethyl)-(1-phenylprop-2-enyl)ammonium
IUPAC Name:carboxymethyl-dodecyl-(2-hydroxyethyl)-(1-phenylprop-2-enyl)azanium
Traditional Name:carboxymethyl-(2-hydroxyethyl)-lauryl-(1-phenylallyl)ammonium
Formula: C25H42NO3+
MolecularWeight: 404.60588
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CCO)(CC(=O)O)C(C=C)C1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCC[N+](CCO)(CC(=O)O)C(C=C)C1=CC=CC=C1


InChI

InChI=1S/C25H41NO3/c1-3-5-6-7-8-9-10-11-12-16-19-26(20-21-27,22-25(28)29)24(4-2)23-17-14-13-15-18-23/h4,13-15,17-18,24,27H,2-3,5-12,16,19-22H2,1H3/p+1


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