methyl 3-(1-phenylethyl)imidazole-4-carboxylate; sulfuric acid

Systemtic Name: methyl 3-(1-phenylethyl)imidazole-4-carboxylate; sulfuric acid Openeye Name: methyl 3-(1-phenylethyl)imidazole-4-carboxylate; sulfuric acid CAS Name: 3-(1-phenylethyl)-4-imidazolecarboxylic acid methyl ester; sulfuric acid IUPAC Name: methyl 3-(1-phenylethyl)imidazole-4-carboxylate; sulfuric acid Traditional Name: 3-(1-phenylethyl)imidazole-4-carboxylic acid methyl ester; sulfuric acid Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C=NC=C2C(=O)OC.OS(=O)(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)N2C=NC=C2C(=O)OC.OS(=O)(=O)O

InChI

InChI=1S/C13H14N2O2.H2O4S/c1-10(11-6-4-3-5-7-11)15-9-14-8-12(15)13(16)17-2;1-5(2,3)4/h3-10H,1-2H3;(H2,1,2,3,4)