(3,3-dimethyl-1-oxidanyl-2,4-dihydro-1H-acridin-9-yl)-hexadecyl-azanium

Systemtic Name: (3,3-dimethyl-1-oxidanyl-2,4-dihydro-1H-acridin-9-yl)-hexadecyl-azanium Openeye Name: hexadecyl-(1-hydroxy-3,3-dimethyl-2,4-dihydro-1H-acridin-9-yl)ammonium CAS Name: hexadecyl-(1-hydroxy-3,3-dimethyl-2,4-dihydro-1H-acridin-9-yl)ammonium IUPAC Name: hexadecyl-(1-hydroxy-3,3-dimethyl-2,4-dihydro-1H-acridin-9-yl)azanium Traditional Name: cetyl-(1-hydroxy-3,3-dimethyl-2,4-dihydro-1H-acridin-9-yl)ammonium Formula: C31H51N2O+ MolecularWeight: 467.74944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH2+]C1=C2C(CC(CC2=NC3=CC=CC=C31)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[NH2+]C1=C2C(CC(CC2=NC3=CC=CC=C31)(C)C)O

InChI

InChI=1S/C31H50N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-32-30-25-20-17-18-21-26(25)33-27-23-31(2,3)24-28(34)29(27)30/h17-18,20-21,28,34H,4-16,19,22-24H2,1-3H3,(H,32,33)/p+1