[(1S)-1-[2-(3-methyl-4-propan-2-yl-phenoxy)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(3-methyl-4-propan-2-yl-phenoxy)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(4-isopropyl-3-methyl-phenoxy)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(3-methyl-4-propan-2-ylphenoxy)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(3-methyl-4-propan-2-ylphenoxy)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-(4-isopropyl-3-methyl-phenoxy)phenyl]ethyl]ammonium Formula: C18H24NO+ MolecularWeight: 270.38926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC=CC=C2C(C)[NH3+])C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC=CC=C2[C@H](C)[NH3+])C(C)C

InChI

InChI=1S/C18H23NO/c1-12(2)16-10-9-15(11-13(16)3)20-18-8-6-5-7-17(18)14(4)19/h5-12,14H,19H2,1-4H3/p+1/t14-/m0/s1