[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-bis(prop-2-enyl)azanium

Systemtic Name: [2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-bis(prop-2-enyl)azanium Openeye Name: diallyl-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]ammonium CAS Name: [2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl-bis(prop-2-enyl)ammonium IUPAC Name: [2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-bis(prop-2-enyl)azanium Traditional Name: diallyl-[[2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]ammonium Formula: C21H30N3O2S+ MolecularWeight: 388.5468

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)C[NH+](CC=C)CC=C

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)C[NH+](CC=C)CC=C

InChI

InChI=1S/C21H29N3O2S/c1-4-14-23(15-5-2)18-20-17-22-21(27(25,26)6-3)24(20)16-10-13-19-11-8-7-9-12-19/h4-5,7-9,11-12,17H,1-2,6,10,13-16,18H2,3H3/p+1