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

Systemtic Name: (4-dimethylaminophenyl)methyl-[(3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenyl-propyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(3S)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-phenyl-propyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(3S)-3-[(4S)-2,2-dimethyl-4-oxanyl]-3-phenylpropyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenylpropyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(3S)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-3-phenyl-propyl]ammonium Formula: C25H37N2O+ MolecularWeight: 381.57408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O/c1-25(2)18-22(15-17-28-25)24(21-8-6-5-7-9-21)14-16-26-19-20-10-12-23(13-11-20)27(3)4/h5-13,22,24,26H,14-19H2,1-4H3/p+1/t22-,24+/m0/s1