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

Systemtic Name: [(3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenyl-propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(3S)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-phenyl-propyl]ammonium CAS Name: [(3S)-3-[(4S)-2,2-dimethyl-4-oxanyl]-3-phenylpropyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenylpropyl]azanium Traditional Name: benzyl-[(3S)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-phenyl-propyl]ammonium Formula: C23H32NO+ MolecularWeight: 338.50628

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CC[NH2+]CC2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C[C@H](CCO1)[C@H](CC[NH2+]CC2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C23H31NO/c1-23(2)17-21(14-16-25-23)22(20-11-7-4-8-12-20)13-15-24-18-19-9-5-3-6-10-19/h3-12,21-22,24H,13-18H2,1-2H3/p+1/t21-,22+/m0/s1