[(3S)-3-(2-methoxyphenyl)-3-piperidin-1-ium-1-yl-propyl]azanium

Systemtic Name: [(3S)-3-(2-methoxyphenyl)-3-piperidin-1-ium-1-yl-propyl]azanium Openeye Name: [(3S)-3-(2-methoxyphenyl)-3-piperidin-1-ium-1-yl-propyl]ammonium CAS Name: [(3S)-3-(2-methoxyphenyl)-3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: [(3S)-3-(2-methoxyphenyl)-3-piperidin-1-ium-1-ylpropyl]azanium Traditional Name: [(3S)-3-(2-methoxyphenyl)-3-piperidin-1-ium-1-yl-propyl]ammonium Formula: C15H26N2O+2 MolecularWeight: 250.37974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CC[NH3+])[NH+]2CCCCC2

Isomeric SMILES

COC1=CC=CC=C1[C@H](CC[NH3+])[NH+]2CCCCC2

InChI

InChI=1S/C15H24N2O/c1-18-15-8-4-3-7-13(15)14(9-10-16)17-11-5-2-6-12-17/h3-4,7-8,14H,2,5-6,9-12,16H2,1H3/p+2/t14-/m0/s1