dimethyl 3-[cyano-[(2-oxidanyl-1-phenyl-ethyl)amino]methyl]cyclopropane-1,2-dicarboxylate

Systemtic Name: dimethyl 3-[cyano-[(2-oxidanyl-1-phenyl-ethyl)amino]methyl]cyclopropane-1,2-dicarboxylate Openeye Name: dimethyl 3-[cyano-[(2-hydroxy-1-phenyl-ethyl)amino]methyl]cyclopropane-1,2-dicarboxylate CAS Name: 3-[cyano-[(2-hydroxy-1-phenylethyl)amino]methyl]cyclopropane-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[cyano-[(2-hydroxy-1-phenylethyl)amino]methyl]cyclopropane-1,2-dicarboxylate Traditional Name: 3-[cyano-[(2-hydroxy-1-phenyl-ethyl)amino]methyl]cyclopropane-1,2-dicarboxylic acid dimethyl ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C1C(=O)OC)C(C#N)NC(CO)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1C(C1C(=O)OC)C(C#N)NC(CO)C2=CC=CC=C2

InChI

InChI=1S/C17H20N2O5/c1-23-16(21)14-13(15(14)17(22)24-2)11(8-18)19-12(9-20)10-6-4-3-5-7-10/h3-7,11-15,19-20H,9H2,1-2H3