[(1S)-1-[(1S,2S)-2-(4-phenylmethoxyphenyl)cyclopropyl]ethyl]azanium

Systemtic Name: [(1S)-1-[(1S,2S)-2-(4-phenylmethoxyphenyl)cyclopropyl]ethyl]azanium Openeye Name: [(1S)-1-[(1S,2S)-2-(4-benzyloxyphenyl)cyclopropyl]ethyl]ammonium CAS Name: [(1S)-1-[(1S,2S)-2-(4-phenylmethoxyphenyl)cyclopropyl]ethyl]ammonium IUPAC Name: [(1S)-1-[(1S,2S)-2-(4-phenylmethoxyphenyl)cyclopropyl]ethyl]azanium Traditional Name: [(1S)-1-[(1S,2S)-2-(4-benzoxyphenyl)cyclopropyl]ethyl]ammonium Formula: C18H22NO+ MolecularWeight: 268.37338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1C2=CC=C(C=C2)OCC3=CC=CC=C3)[NH3+]

Isomeric SMILES

C[C@@H]([C@H]1C[C@@H]1C2=CC=C(C=C2)OCC3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C18H21NO/c1-13(19)17-11-18(17)15-7-9-16(10-8-15)20-12-14-5-3-2-4-6-14/h2-10,13,17-18H,11-12,19H2,1H3/p+1/t13-,17+,18+/m0/s1