1-[(10-octadecyl-9H-acridin-10-ium-10-yl)methyl]pyrrolidin-2-one

Systemtic Name: 1-[(10-octadecyl-9H-acridin-10-ium-10-yl)methyl]pyrrolidin-2-one Openeye Name: 1-[(10-octadecyl-9H-acridin-10-ium-10-yl)methyl]pyrrolidin-2-one CAS Name: 1-[(10-octadecyl-9H-acridin-10-ium-10-yl)methyl]-2-pyrrolidinone IUPAC Name: 1-[(10-octadecyl-9H-acridin-10-ium-10-yl)methyl]pyrrolidin-2-one Traditional Name: 1-[(10-stearyl-9H-acridin-10-ium-10-yl)methyl]-2-pyrrolidone Formula: C36H55N2O+ MolecularWeight: 531.8347

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+]1(C2=CC=CC=C2CC3=CC=CC=C31)CN4CCCC4=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+]1(C2=CC=CC=C2CC3=CC=CC=C31)CN4CCCC4=O

InChI

InChI=1S/C36H55N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-29-38(31-37-28-22-27-36(37)39)34-25-19-17-23-32(34)30-33-24-18-20-26-35(33)38/h17-20,23-26H,2-16,21-22,27-31H2,1H3/q+1