2-dimethylaminoethyl-[(2S)-2-(3-ethoxy-4-methoxy-phenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: 2-dimethylaminoethyl-[(2S)-2-(3-ethoxy-4-methoxy-phenyl)-2-oxidanyl-ethyl]azanium Openeye Name: 2-dimethylaminoethyl-[(2S)-2-(3-ethoxy-4-methoxy-phenyl)-2-hydroxy-ethyl]ammonium CAS Name: 2-dimethylaminoethyl-[(2S)-2-(3-ethoxy-4-methoxyphenyl)-2-hydroxyethyl]ammonium IUPAC Name: 2-dimethylaminoethyl-[(2S)-2-(3-ethoxy-4-methoxyphenyl)-2-hydroxyethyl]azanium Traditional Name: 2-dimethylaminoethyl-[(2S)-2-(3-ethoxy-4-methoxy-phenyl)-2-hydroxy-ethyl]ammonium Formula: C15H27N2O3+ MolecularWeight: 283.38648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C[NH2+]CCN(C)C)O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H](C[NH2+]CCN(C)C)O)OC

InChI

InChI=1S/C15H26N2O3/c1-5-20-15-10-12(6-7-14(15)19-4)13(18)11-16-8-9-17(2)3/h6-7,10,13,16,18H,5,8-9,11H2,1-4H3/p+1/t13-/m1/s1