[(2S)-1-methoxypropan-2-yl]-[1-[4-(3-methylphenyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: [(2S)-1-methoxypropan-2-yl]-[1-[4-(3-methylphenyl)phenyl]piperidin-4-yl]azanium Openeye Name: [(1S)-2-methoxy-1-methyl-ethyl]-[1-[4-(m-tolyl)phenyl]-4-piperidyl]ammonium CAS Name: [(2S)-1-methoxypropan-2-yl]-[1-[4-(3-methylphenyl)phenyl]-4-piperidinyl]ammonium IUPAC Name: [(2S)-1-methoxypropan-2-yl]-[1-[4-(3-methylphenyl)phenyl]piperidin-4-yl]azanium Traditional Name: [(1S)-2-methoxy-1-methyl-ethyl]-[1-[4-(m-tolyl)phenyl]-4-piperidyl]ammonium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]C(C)COC

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC=C(C=C2)N3CCC(CC3)[NH2+][C@@H](C)COC

InChI

InChI=1S/C22H30N2O/c1-17-5-4-6-20(15-17)19-7-9-22(10-8-19)24-13-11-21(12-14-24)23-18(2)16-25-3/h4-10,15,18,21,23H,11-14,16H2,1-3H3/p+1/t18-/m0/s1