cyclopropyl-[(2S)-2-oxidanyl-2-[4-(2-propan-2-ylphenoxy)phenyl]ethyl]azanium

Systemtic Name: cyclopropyl-[(2S)-2-oxidanyl-2-[4-(2-propan-2-ylphenoxy)phenyl]ethyl]azanium Openeye Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-(2-isopropylphenoxy)phenyl]ethyl]ammonium CAS Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-(2-propan-2-ylphenoxy)phenyl]ethyl]ammonium IUPAC Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-(2-propan-2-ylphenoxy)phenyl]ethyl]azanium Traditional Name: cyclopropyl-[(2S)-2-hydroxy-2-[4-(2-isopropylphenoxy)phenyl]ethyl]ammonium Formula: C20H26NO2+ MolecularWeight: 312.42594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC2=CC=C(C=C2)C(C[NH2+]C3CC3)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=CC=C(C=C2)[C@@H](C[NH2+]C3CC3)O

InChI

InChI=1S/C20H25NO2/c1-14(2)18-5-3-4-6-20(18)23-17-11-7-15(8-12-17)19(22)13-21-16-9-10-16/h3-8,11-12,14,16,19,21-22H,9-10,13H2,1-2H3/p+1/t19-/m1/s1