methyl (3S,4R)-1-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4R)-1-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4R)-1-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]pyrrolidine-3-carboxylate CAS Name: (3S,4R)-1-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-1-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidine-3-carboxylate Traditional Name: (3S,4R)-1-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]pyrrolidine-3-carboxylic acid methyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CN(CC2C(=O)OC)C#N)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CN(C[C@H]2C(=O)OC)C#N)OC3CCCC3

InChI

InChI=1S/C19H24N2O4/c1-23-17-8-7-13(9-18(17)25-14-5-3-4-6-14)15-10-21(12-20)11-16(15)19(22)24-2/h7-9,14-16H,3-6,10-11H2,1-2H3/t15-,16+/m0/s1