[(1R)-2-azaniumyl-1-(3-propoxyphenyl)ethyl]-methyl-(1-methylpiperidin-4-yl)azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(3-propoxyphenyl)ethyl]-methyl-(1-methylpiperidin-4-yl)azanium Openeye Name: [(1R)-2-azaniumyl-1-(3-propoxyphenyl)ethyl]-methyl-(1-methyl-4-piperidyl)ammonium CAS Name: [(1R)-2-ammonio-1-(3-propoxyphenyl)ethyl]-methyl-(1-methyl-4-piperidinyl)ammonium IUPAC Name: [(1R)-2-azaniumyl-1-(3-propoxyphenyl)ethyl]-methyl-(1-methylpiperidin-4-yl)azanium Traditional Name: [(1R)-2-ammonio-1-(3-propoxyphenyl)ethyl]-methyl-(1-methyl-4-piperidyl)ammonium Formula: C18H33N3O+2 MolecularWeight: 307.47412

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(C[NH3+])[NH+](C)C2CCN(CC2)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@H](C[NH3+])[NH+](C)C2CCN(CC2)C

InChI

InChI=1S/C18H31N3O/c1-4-12-22-17-7-5-6-15(13-17)18(14-19)21(3)16-8-10-20(2)11-9-16/h5-7,13,16,18H,4,8-12,14,19H2,1-3H3/p+2/t18-/m0/s1