(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium

Systemtic Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Openeye Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-methyl-[(1S)-tetralin-1-yl]ammonium CAS Name: (3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]ammonium IUPAC Name: (3-butyl-2-ethylsulfonylimidazol-4-yl)methyl-methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Traditional Name: (3-butyl-2-esyl-imidazol-4-yl)methyl-methyl-[(1S)-tetralin-1-yl]ammonium Formula: C21H32N3O2S+ MolecularWeight: 390.56268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)C2CCCC3=CC=CC=C23

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)[C@H]2CCCC3=CC=CC=C23

InChI

InChI=1S/C21H31N3O2S/c1-4-6-14-24-18(15-22-21(24)27(25,26)5-2)16-23(3)20-13-9-11-17-10-7-8-12-19(17)20/h7-8,10,12,15,20H,4-6,9,11,13-14,16H2,1-3H3/p+1/t20-/m0/s1