[(3R,5S)-5-(C-methoxycarbonimidoyl)oxolan-3-yl]methyl benzoate hydrochloride

Systemtic Name: [(3R,5S)-5-(C-methoxycarbonimidoyl)oxolan-3-yl]methyl benzoate hydrochloride Openeye Name: [(3R,5S)-5-(methoxycarbonimidoyl)tetrahydrofuran-3-yl]methyl benzoate hydrochloride CAS Name: benzoic acid [(3R,5S)-5-[imino(methoxy)methyl]-3-oxolanyl]methyl ester hydrochloride IUPAC Name: [(3R,5S)-5-(C-methoxycarbonimidoyl)oxolan-3-yl]methyl benzoate hydrochloride Traditional Name: benzoic acid [(3R,5S)-5-(methoxycarbonimidoyl)tetrahydrofuran-3-yl]methyl ester hydrochloride Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

COC(=N)C1CC(CO1)COC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

COC(=N)[C@@H]1C[C@H](CO1)COC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C14H17NO4.ClH/c1-17-13(15)12-7-10(8-18-12)9-19-14(16)11-5-3-2-4-6-11;/h2-6,10,12,15H,7-9H2,1H3;1H/t10-,12+;/m1./s1