[(E)-2-methylnonadec-10-en-2-yl]-(phenylmethyl)azanium

Systemtic Name: [(E)-2-methylnonadec-10-en-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-[(E)-1,1-dimethyloctadec-9-enyl]ammonium CAS Name: [(E)-2-methylnonadec-10-en-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(E)-2-methylnonadec-10-en-2-yl]azanium Traditional Name: benzyl-[(E)-1,1-dimethyloctadec-9-enyl]ammonium Formula: C27H48N+ MolecularWeight: 386.67672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(C)(C)[NH2+]CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(C)(C)[NH2+]CC1=CC=CC=C1

InChI

InChI=1S/C27H47N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-27(2,3)28-25-26-22-19-18-20-23-26/h11-12,18-20,22-23,28H,4-10,13-17,21,24-25H2,1-3H3/p+1/b12-11+