3-imidazol-1-ylpropyl-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]azanium Openeye Name: 3-imidazol-1-ylpropyl-[(1S)-1-(4-isobutylphenyl)ethyl]ammonium CAS Name: 3-(1-imidazolyl)propyl-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]ammonium IUPAC Name: 3-imidazol-1-ylpropyl-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]azanium Traditional Name: 3-imidazol-1-ylpropyl-[(1S)-1-(4-isobutylphenyl)ethyl]ammonium Formula: C18H28N3+ MolecularWeight: 286.43502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)[NH2+]CCCN2C=CN=C2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)CC(C)C)[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C18H27N3/c1-15(2)13-17-5-7-18(8-6-17)16(3)20-9-4-11-21-12-10-19-14-21/h5-8,10,12,14-16,20H,4,9,11,13H2,1-3H3/p+1/t16-/m0/s1