[(2S)-2-(3-methoxy-4-phenethyloxy-phenyl)-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-2-(3-methoxy-4-phenethyloxy-phenyl)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-2-(3-methoxy-4-phenethyloxy-phenyl)propyl]ammonium CAS Name: [(2S)-2-hydroxy-2-(3-methoxy-4-phenethyloxyphenyl)propyl]ammonium IUPAC Name: [(2S)-2-hydroxy-2-(3-methoxy-4-phenethyloxyphenyl)propyl]azanium Traditional Name: [(2S)-2-hydroxy-2-(3-methoxy-4-phenethyloxy-phenyl)propyl]ammonium Formula: C18H24NO3+ MolecularWeight: 302.38806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH3+])(C1=CC(=C(C=C1)OCCC2=CC=CC=C2)OC)O

Isomeric SMILES

C[C@@](C[NH3+])(C1=CC(=C(C=C1)OCCC2=CC=CC=C2)OC)O

InChI

InChI=1S/C18H23NO3/c1-18(20,13-19)15-8-9-16(17(12-15)21-2)22-11-10-14-6-4-3-5-7-14/h3-9,12,20H,10-11,13,19H2,1-2H3/p+1/t18-/m1/s1