1-[2-[(3S)-6,6-dimethyl-3-phenyl-oxan-3-yl]ethyl]pyrrolidin-1-ium

Systemtic Name: 1-[2-[(3S)-6,6-dimethyl-3-phenyl-oxan-3-yl]ethyl]pyrrolidin-1-ium Openeye Name: 1-[2-[(3S)-6,6-dimethyl-3-phenyl-tetrahydropyran-3-yl]ethyl]pyrrolidin-1-ium CAS Name: 1-[2-[(3S)-6,6-dimethyl-3-phenyl-3-oxanyl]ethyl]pyrrolidin-1-ium IUPAC Name: 1-[2-[(3S)-6,6-dimethyl-3-phenyloxan-3-yl]ethyl]pyrrolidin-1-ium Traditional Name: 1-[2-[(3S)-6,6-dimethyl-3-phenyl-tetrahydropyran-3-yl]ethyl]pyrrolidin-1-ium Formula: C19H30NO+ MolecularWeight: 288.4476

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CO1)(CC[NH+]2CCCC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC[C@](CO1)(CC[NH+]2CCCC2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H29NO/c1-18(2)10-11-19(16-21-18,17-8-4-3-5-9-17)12-15-20-13-6-7-14-20/h3-5,8-9H,6-7,10-16H2,1-2H3/p+1/t19-/m1/s1