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

Systemtic Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenyl-propyl]azanium Openeye Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-phenyl-propyl]ammonium CAS Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyl-4-oxanyl]-3-phenylpropyl]ammonium IUPAC Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenylpropyl]azanium Traditional Name: 2-dimethylaminoethyl-[(3R)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-phenyl-propyl]ammonium Formula: C20H35N2O+ MolecularWeight: 319.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CC[NH2+]CCN(C)C)C2=CC=CC=C2)C

Isomeric SMILES

CC1(C[C@H](CCO1)[C@@H](CC[NH2+]CCN(C)C)C2=CC=CC=C2)C

InChI

InChI=1S/C20H34N2O/c1-20(2)16-18(11-15-23-20)19(17-8-6-5-7-9-17)10-12-21-13-14-22(3)4/h5-9,18-19,21H,10-16H2,1-4H3/p+1/t18-,19-/m0/s1