dimethyl-[1-(2-methylprop-2-enoylamino)propyl]-(1-phenyltridecyl)azanium

Systemtic Name: dimethyl-[1-(2-methylprop-2-enoylamino)propyl]-(1-phenyltridecyl)azanium Openeye Name: dimethyl-[1-(2-methylprop-2-enoylamino)propyl]-(1-phenyltridecyl)ammonium CAS Name: dimethyl-[1-[(2-methyl-1-oxoprop-2-enyl)amino]propyl]-(1-phenyltridecyl)ammonium IUPAC Name: dimethyl-[1-(2-methylprop-2-enoylamino)propyl]-(1-phenyltridecyl)azanium Traditional Name: 1-methacrylamidopropyl-dimethyl-(1-phenyltridecyl)ammonium Formula: C28H49N2O+ MolecularWeight: 429.70146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=CC=CC=C1)[N+](C)(C)C(CC)NC(=O)C(=C)C

Isomeric SMILES

CCCCCCCCCCCCC(C1=CC=CC=C1)[N+](C)(C)C(CC)NC(=O)C(=C)C

InChI

InChI=1S/C28H48N2O/c1-7-9-10-11-12-13-14-15-16-20-23-26(25-21-18-17-19-22-25)30(5,6)27(8-2)29-28(31)24(3)4/h17-19,21-22,26-27H,3,7-16,20,23H2,1-2,4-6H3/p+1