1-[2-(2-ethoxyphenyl)-2-prop-2-enoxy-ethyl]-3-heptyl-2H-imidazole sulfate

Systemtic Name: 1-[2-(2-ethoxyphenyl)-2-prop-2-enoxy-ethyl]-3-heptyl-2H-imidazole sulfate Openeye Name: 1-[2-allyloxy-2-(2-ethoxyphenyl)ethyl]-3-heptyl-2H-imidazole sulfate CAS Name: 1-[2-(2-ethoxyphenyl)-2-prop-2-enoxyethyl]-3-heptyl-2H-imidazole sulfate IUPAC Name: 1-[2-(2-ethoxyphenyl)-2-prop-2-enoxyethyl]-3-heptyl-2H-imidazole sulfate Traditional Name: 1-(2-allyloxy-2-o-phenetyl-ethyl)-3-heptyl-4-imidazoline sulfate Formula: C23H36N2O6S-2 MolecularWeight: 468.60674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CN(C=C1)CC(C2=CC=CC=C2OCC)OCC=C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCN1CN(C=C1)CC(C2=CC=CC=C2OCC)OCC=C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C23H36N2O2.H2O4S/c1-4-7-8-9-12-15-24-16-17-25(20-24)19-23(27-18-5-2)21-13-10-11-14-22(21)26-6-3;1-5(2,3)4/h5,10-11,13-14,16-17,23H,2,4,6-9,12,15,18-20H2,1,3H3;(H2,1,2,3,4)/p-2