[4-[(E)-2-cyano-3-oxidanylidene-3-[[(2R)-oxolan-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate

Systemtic Name: [4-[(E)-2-cyano-3-oxidanylidene-3-[[(2R)-oxolan-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate Openeye Name: [4-[(E)-2-cyano-3-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-3-oxo-3-[[(2R)-2-oxolanyl]methylamino]prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-oxo-3-[[(2R)-oxolan-2-yl]methylamino]prop-1-enyl]-2-methoxyphenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-3-keto-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2CCCO2)OC(=O)C3CC3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC[C@H]2CCCO2)OC(=O)C3CC3

InChI

InChI=1S/C20H22N2O5/c1-25-18-10-13(4-7-17(18)27-20(24)14-5-6-14)9-15(11-21)19(23)22-12-16-3-2-8-26-16/h4,7,9-10,14,16H,2-3,5-6,8,12H2,1H3,(H,22,23)/b15-9+/t16-/m1/s1