(2R,4S)-1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4-methoxy-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4-methoxy-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4-methoxy-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-4-methoxy-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4-methoxypyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-[(E)-3-(4-chlorophenyl)acryloyl]-4-methoxy-pyrrolidine-2-carboxylate Formula: C15H15ClNO4- MolecularWeight: 308.7369

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C=CC2=CC=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClNO4/c1-21-12-8-13(15(19)20)17(9-12)14(18)7-4-10-2-5-11(16)6-3-10/h2-7,12-13H,8-9H2,1H3,(H,19,20)/p-1/b7-4+/t12-,13+/m0/s1