3-(3-butyl-2-oxidanylidene-pyrrolidin-1-yl)pentan-3-yl-(2,4,6-triethylhexadecyl)azanium

Systemtic Name: 3-(3-butyl-2-oxidanylidene-pyrrolidin-1-yl)pentan-3-yl-(2,4,6-triethylhexadecyl)azanium Openeye Name: [1-(3-butyl-2-oxo-pyrrolidin-1-yl)-1-ethyl-propyl]-(2,4,6-triethylhexadecyl)ammonium CAS Name: 3-(3-butyl-2-oxo-1-pyrrolidinyl)pentan-3-yl-(2,4,6-triethylhexadecyl)ammonium IUPAC Name: 3-(3-butyl-2-oxopyrrolidin-1-yl)pentan-3-yl-(2,4,6-triethylhexadecyl)azanium Traditional Name: [1-(3-butyl-2-keto-pyrrolidino)-1-ethyl-propyl]-(2,4,6-triethylhexadecyl)ammonium Formula: C35H71N2O+ MolecularWeight: 535.95104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC)CC(CC)CC(CC)C[NH2+]C(CC)(CC)N1CCC(C1=O)CCCC

Isomeric SMILES

CCCCCCCCCCC(CC)CC(CC)CC(CC)C[NH2+]C(CC)(CC)N1CCC(C1=O)CCCC

InChI

InChI=1S/C35H70N2O/c1-8-15-17-18-19-20-21-22-23-30(10-3)27-31(11-4)28-32(12-5)29-36-35(13-6,14-7)37-26-25-33(34(37)38)24-16-9-2/h30-33,36H,8-29H2,1-7H3/p+1