[(1R)-2-azaniumyl-1-(4-butoxy-3-chloranyl-5-methoxy-phenyl)ethyl]-diethyl-azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(4-butoxy-3-chloranyl-5-methoxy-phenyl)ethyl]-diethyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(4-butoxy-3-chloro-5-methoxy-phenyl)ethyl]-diethyl-ammonium CAS Name: [(1R)-2-ammonio-1-(4-butoxy-3-chloro-5-methoxyphenyl)ethyl]-diethylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(4-butoxy-3-chloro-5-methoxyphenyl)ethyl]-diethylazanium Traditional Name: [(1R)-2-ammonio-1-(4-butoxy-3-chloro-5-methoxy-phenyl)ethyl]-diethyl-ammonium Formula: C17H31ClN2O2+2 MolecularWeight: 330.89324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(C[NH3+])[NH+](CC)CC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)[C@H](C[NH3+])[NH+](CC)CC)OC

InChI

InChI=1S/C17H29ClN2O2/c1-5-8-9-22-17-14(18)10-13(11-16(17)21-4)15(12-19)20(6-2)7-3/h10-11,15H,5-9,12,19H2,1-4H3/p+2/t15-/m0/s1