2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-(4-methylphenyl)propyl]azanium

Systemtic Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-(4-methylphenyl)propyl]azanium Openeye Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-(p-tolyl)propyl]ammonium CAS Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyl-4-oxanyl]-3-(4-methylphenyl)propyl]ammonium IUPAC Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-(4-methylphenyl)propyl]azanium Traditional Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-(p-tolyl)propyl]ammonium Formula: C21H37N2O+ MolecularWeight: 333.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC[NH2+]CCN(C)C)C2CCOC(C2)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CC[NH2+]CCN(C)C)[C@H]2CCOC(C2)(C)C

InChI

InChI=1S/C21H36N2O/c1-17-6-8-18(9-7-17)20(10-12-22-13-14-23(4)5)19-11-15-24-21(2,3)16-19/h6-9,19-20,22H,10-16H2,1-5H3/p+1/t19-,20-/m0/s1