2-diethylaminoethyl-[(2S)-3-[(R)-(4-methylphenyl)-phenyl-methoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: 2-diethylaminoethyl-[(2S)-3-[(R)-(4-methylphenyl)-phenyl-methoxy]-2-oxidanyl-propyl]azanium Openeye Name: 2-diethylaminoethyl-[(2S)-2-hydroxy-3-[(R)-phenyl(p-tolyl)methoxy]propyl]ammonium CAS Name: 2-diethylaminoethyl-[(2S)-2-hydroxy-3-[(R)-(4-methylphenyl)-phenylmethoxy]propyl]ammonium IUPAC Name: 2-diethylaminoethyl-[(2S)-2-hydroxy-3-[(R)-(4-methylphenyl)-phenylmethoxy]propyl]azanium Traditional Name: 2-diethylaminoethyl-[(2S)-2-hydroxy-3-[(R)-phenyl(p-tolyl)methoxy]propyl]ammonium Formula: C23H35N2O2+ MolecularWeight: 371.5362

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[NH2+]CC(COC(C1=CC=CC=C1)C2=CC=C(C=C2)C)O

Isomeric SMILES

CCN(CC)CC[NH2+]C[C@@H](CO[C@H](C1=CC=CC=C1)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C23H34N2O2/c1-4-25(5-2)16-15-24-17-22(26)18-27-23(20-9-7-6-8-10-20)21-13-11-19(3)12-14-21/h6-14,22-24,26H,4-5,15-18H2,1-3H3/p+1/t22-,23+/m0/s1