[(4S)-4-(4-methoxyphenyl)-4-piperidin-1-ium-1-yl-butyl]azanium

Systemtic Name: [(4S)-4-(4-methoxyphenyl)-4-piperidin-1-ium-1-yl-butyl]azanium Openeye Name: [(4S)-4-(4-methoxyphenyl)-4-piperidin-1-ium-1-yl-butyl]ammonium CAS Name: [(4S)-4-(4-methoxyphenyl)-4-(1-piperidin-1-iumyl)butyl]ammonium IUPAC Name: [(4S)-4-(4-methoxyphenyl)-4-piperidin-1-ium-1-ylbutyl]azanium Traditional Name: [(4S)-4-(4-methoxyphenyl)-4-piperidin-1-ium-1-yl-butyl]ammonium Formula: C16H28N2O+2 MolecularWeight: 264.40632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O/c1-19-15-9-7-14(8-10-15)16(6-5-11-17)18-12-3-2-4-13-18/h7-10,16H,2-6,11-13,17H2,1H3/p+2/t16-/m0/s1