[(1S)-2-azaniumyl-1-(3-methoxy-4-propoxy-phenyl)ethyl]-butyl-ethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(3-methoxy-4-propoxy-phenyl)ethyl]-butyl-ethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-methoxy-4-propoxy-phenyl)ethyl]-butyl-ethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-methoxy-4-propoxyphenyl)ethyl]-butyl-ethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3-methoxy-4-propoxyphenyl)ethyl]-butyl-ethylazanium Traditional Name: [(1S)-2-ammonio-1-(3-methoxy-4-propoxy-phenyl)ethyl]-butyl-ethyl-ammonium Formula: C18H34N2O2+2 MolecularWeight: 310.47476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C(C[NH3+])C1=CC(=C(C=C1)OCCC)OC

Isomeric SMILES

CCCC[NH+](CC)[C@H](C[NH3+])C1=CC(=C(C=C1)OCCC)OC

InChI

InChI=1S/C18H32N2O2/c1-5-8-11-20(7-3)16(14-19)15-9-10-17(22-12-6-2)18(13-15)21-4/h9-10,13,16H,5-8,11-12,14,19H2,1-4H3/p+2/t16-/m1/s1