[(2S)-2-[ethyl-(phenylmethyl)amino]-2-(4-methoxy-3-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: [(2S)-2-[ethyl-(phenylmethyl)amino]-2-(4-methoxy-3-oxidanyl-phenyl)ethyl]azanium Openeye Name: [(2S)-2-[benzyl(ethyl)amino]-2-(3-hydroxy-4-methoxy-phenyl)ethyl]ammonium CAS Name: [(2S)-2-[ethyl-(phenylmethyl)amino]-2-(3-hydroxy-4-methoxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-2-[benzyl(ethyl)amino]-2-(3-hydroxy-4-methoxyphenyl)ethyl]azanium Traditional Name: [(2S)-2-[benzyl(ethyl)amino]-2-(3-hydroxy-4-methoxy-phenyl)ethyl]ammonium Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(C[NH3+])C2=CC(=C(C=C2)OC)O

Isomeric SMILES

CCN(CC1=CC=CC=C1)[C@H](C[NH3+])C2=CC(=C(C=C2)OC)O

InChI

InChI=1S/C18H24N2O2/c1-3-20(13-14-7-5-4-6-8-14)16(12-19)15-9-10-18(22-2)17(21)11-15/h4-11,16,21H,3,12-13,19H2,1-2H3/p+1/t16-/m1/s1