(2S,4S)-1-[(4-cyanophenyl)carbamoyl]-4-methoxy-pyrrolidine-2-carboxylate

Systemtic Name: (2S,4S)-1-[(4-cyanophenyl)carbamoyl]-4-methoxy-pyrrolidine-2-carboxylate Openeye Name: (2S,4S)-1-[(4-cyanophenyl)carbamoyl]-4-methoxy-pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-[(4-cyanoanilino)-oxomethyl]-4-methoxy-2-pyrrolidinecarboxylate IUPAC Name: (2S,4S)-1-[(4-cyanophenyl)carbamoyl]-4-methoxypyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-[(4-cyanophenyl)carbamoyl]-4-methoxy-pyrrolidine-2-carboxylate Formula: C14H14N3O4- MolecularWeight: 288.27866

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)NC2=CC=C(C=C2)C#N)C(=O)[O-]

Isomeric SMILES

CO[C@H]1C[C@H](N(C1)C(=O)NC2=CC=C(C=C2)C#N)C(=O)[O-]

InChI

InChI=1S/C14H15N3O4/c1-21-11-6-12(13(18)19)17(8-11)14(20)16-10-4-2-9(7-15)3-5-10/h2-5,11-12H,6,8H2,1H3,(H,16,20)(H,18,19)/p-1/t11-,12-/m0/s1