methyl 2-oxidanylidene-8-(phenylmethyl)-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate hydrochloride

Systemtic Name: methyl 2-oxidanylidene-8-(phenylmethyl)-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate hydrochloride Openeye Name: methyl 8-benzyl-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate hydrochloride CAS Name: 2-oxo-8-(phenylmethyl)-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester hydrochloride IUPAC Name: methyl 8-benzyl-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate hydrochloride Traditional Name: 8-benzyl-2-keto-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester hydrochloride Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2C(=O)C=CC1N2CC3=CC=CC=C3.Cl

Isomeric SMILES

COC(=O)C1CC2C(=O)C=CC1N2CC3=CC=CC=C3.Cl

InChI

InChI=1S/C16H17NO3.ClH/c1-20-16(19)12-9-14-15(18)8-7-13(12)17(14)10-11-5-3-2-4-6-11;/h2-8,12-14H,9-10H2,1H3;1H