[(1R)-2-azaniumyl-1-(5-chloranyl-2-propoxy-phenyl)ethyl]-dipropyl-azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(5-chloranyl-2-propoxy-phenyl)ethyl]-dipropyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(5-chloro-2-propoxy-phenyl)ethyl]-dipropyl-ammonium CAS Name: [(1R)-2-ammonio-1-(5-chloro-2-propoxyphenyl)ethyl]-dipropylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(5-chloro-2-propoxyphenyl)ethyl]-dipropylazanium Traditional Name: [(1R)-2-ammonio-1-(5-chloro-2-propoxy-phenyl)ethyl]-dipropyl-ammonium Formula: C17H31ClN2O+2 MolecularWeight: 314.89384

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)C(C[NH3+])C1=C(C=CC(=C1)Cl)OCCC

Isomeric SMILES

CCC[NH+](CCC)[C@@H](C[NH3+])C1=C(C=CC(=C1)Cl)OCCC

InChI

InChI=1S/C17H29ClN2O/c1-4-9-20(10-5-2)16(13-19)15-12-14(18)7-8-17(15)21-11-6-3/h7-8,12,16H,4-6,9-11,13,19H2,1-3H3/p+2/t16-/m0/s1