dimethyl-[3-[[(Z)-octadec-9-enoyl]amino]propyl]-(phenylmethyl)azanium

Systemtic Name: dimethyl-[3-[[(Z)-octadec-9-enoyl]amino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-dimethyl-[3-[[(Z)-octadec-9-enoyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[(Z)-1-oxooctadec-9-enyl]amino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-dimethyl-[3-[[(Z)-octadec-9-enoyl]amino]propyl]azanium Traditional Name: benzyl-dimethyl-[3-[[(Z)-octadec-9-enoyl]amino]propyl]ammonium Formula: C30H53N2O+ MolecularWeight: 457.75462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1

InChI

InChI=1S/C30H52N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-30(33)31-26-22-27-32(2,3)28-29-23-19-18-20-24-29/h11-12,18-20,23-24H,4-10,13-17,21-22,25-28H2,1-3H3/p+1/b12-11-