(4-acetamidophenyl)methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]azanium

Systemtic Name: (4-acetamidophenyl)methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]azanium Openeye Name: (4-acetamidophenyl)methyl-[(1S)-1-(4-isopropylphenyl)-2-methyl-propyl]ammonium CAS Name: (4-acetamidophenyl)methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]ammonium IUPAC Name: (4-acetamidophenyl)methyl-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]azanium Traditional Name: (4-acetamidobenzyl)-[(1S)-2-methyl-1-p-cumenyl-propyl]ammonium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C(C)C)[NH2+]CC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@H](C(C)C)[NH2+]CC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C22H30N2O/c1-15(2)19-8-10-20(11-9-19)22(16(3)4)23-14-18-6-12-21(13-7-18)24-17(5)25/h6-13,15-16,22-23H,14H2,1-5H3,(H,24,25)/p+1/t22-/m0/s1