2-[di(propan-2-yl)amino]ethyl-[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: 2-[di(propan-2-yl)amino]ethyl-[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]azanium Openeye Name: 2-(diisopropylamino)ethyl-[(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]ammonium CAS Name: 2-[di(propan-2-yl)amino]ethyl-[(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]ammonium IUPAC Name: 2-[di(propan-2-yl)amino]ethyl-[(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]azanium Traditional Name: 2-(diisopropylamino)ethyl-[(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]ammonium Formula: C17H31N2O2+ MolecularWeight: 295.44024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC[NH2+]C(C)C1=CC(=C(C=C1)O)OC)C(C)C

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)O)OC)[NH2+]CCN(C(C)C)C(C)C

InChI

InChI=1S/C17H30N2O2/c1-12(2)19(13(3)4)10-9-18-14(5)15-7-8-16(20)17(11-15)21-6/h7-8,11-14,18,20H,9-10H2,1-6H3/p+1/t14-/m0/s1