[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: [2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]-ethyl-ammonium CAS Name: [2-cyclopentylsulfonyl-3-(3-methoxypropyl)-4-imidazolyl]methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]-ethylazanium Traditional Name: benzyl-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]-ethyl-ammonium Formula: C22H34N3O3S+ MolecularWeight: 420.58866

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC2=CN=C(N2CCCOC)S(=O)(=O)C3CCCC3

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC2=CN=C(N2CCCOC)S(=O)(=O)C3CCCC3

InChI

InChI=1S/C22H33N3O3S/c1-3-24(17-19-10-5-4-6-11-19)18-20-16-23-22(25(20)14-9-15-28-2)29(26,27)21-12-7-8-13-21/h4-6,10-11,16,21H,3,7-9,12-15,17-18H2,1-2H3/p+1