[(2R)-2-(3-methoxy-4-propan-2-yloxy-phenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(3-methoxy-4-propan-2-yloxy-phenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(4-isopropoxy-3-methoxy-phenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(3-methoxy-4-propan-2-yloxyphenyl)-2-[(3R)-3-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(3-methoxy-4-propan-2-yloxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(4-isopropoxy-3-methoxy-phenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C18H32N2O2+2 MolecularWeight: 308.45888

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C[NH3+])C2=CC(=C(C=C2)OC(C)C)OC

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)[C@@H](C[NH3+])C2=CC(=C(C=C2)OC(C)C)OC

InChI

InChI=1S/C18H30N2O2/c1-13(2)22-17-8-7-15(10-18(17)21-4)16(11-19)20-9-5-6-14(3)12-20/h7-8,10,13-14,16H,5-6,9,11-12,19H2,1-4H3/p+2/t14-,16+/m1/s1