cyclopropyl-[(2S)-2-[4-[(4-methylphenyl)methoxy]phenyl]-2-oxidanyl-propyl]azanium

Systemtic Name: cyclopropyl-[(2S)-2-[4-[(4-methylphenyl)methoxy]phenyl]-2-oxidanyl-propyl]azanium Openeye Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-(p-tolylmethoxy)phenyl]propyl]ammonium CAS Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-[(4-methylphenyl)methoxy]phenyl]propyl]ammonium IUPAC Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-[(4-methylphenyl)methoxy]phenyl]propyl]azanium Traditional Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-(4-methylbenzyl)oxyphenyl]propyl]ammonium Formula: C20H26NO2+ MolecularWeight: 312.42594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(C)(C[NH2+]C3CC3)O

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=C(C=C2)[C@@](C)(C[NH2+]C3CC3)O

InChI

InChI=1S/C20H25NO2/c1-15-3-5-16(6-4-15)13-23-19-11-7-17(8-12-19)20(2,22)14-21-18-9-10-18/h3-8,11-12,18,21-22H,9-10,13-14H2,1-2H3/p+1/t20-/m1/s1