[(2R)-1-butyl-3,4-dimethyl-5-oxidanylidene-2H-pyrrol-2-yl]-cyclododecyl-azanium

Systemtic Name: [(2R)-1-butyl-3,4-dimethyl-5-oxidanylidene-2H-pyrrol-2-yl]-cyclododecyl-azanium Openeye Name: [(2R)-1-butyl-3,4-dimethyl-5-oxo-2H-pyrrol-2-yl]-cyclododecyl-ammonium CAS Name: [(2R)-1-butyl-3,4-dimethyl-5-oxo-2H-pyrrol-2-yl]-cyclododecylammonium IUPAC Name: [(2R)-1-butyl-3,4-dimethyl-5-oxo-2H-pyrrol-2-yl]-cyclododecylazanium Traditional Name: [(2R)-1-butyl-5-keto-3,4-dimethyl-3-pyrrolin-2-yl]-cyclododecyl-ammonium Formula: C22H41N2O+ MolecularWeight: 349.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(=C(C1=O)C)C)[NH2+]C2CCCCCCCCCCC2

Isomeric SMILES

CCCCN1[C@H](C(=C(C1=O)C)C)[NH2+]C2CCCCCCCCCCC2

InChI

InChI=1S/C22H40N2O/c1-4-5-17-24-21(18(2)19(3)22(24)25)23-20-15-13-11-9-7-6-8-10-12-14-16-20/h20-21,23H,4-17H2,1-3H3/p+1/t21-/m1/s1