methyl (2S)-1-(2-azido-5-methoxy-4-phenylmethoxy-phenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-(2-azido-5-methoxy-4-phenylmethoxy-phenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-(2-azido-4-benzyloxy-5-methoxy-benzoyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2-azido-5-methoxy-4-phenylmethoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(2-azido-5-methoxy-4-phenylmethoxybenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-azido-4-benzoxy-5-methoxy-benzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCCC2C(=O)OC)N=[N+]=[N-])OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC[C@H]2C(=O)OC)N=[N+]=[N-])OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O5/c1-28-18-11-15(20(26)25-10-6-9-17(25)21(27)29-2)16(23-24-22)12-19(18)30-13-14-7-4-3-5-8-14/h3-5,7-8,11-12,17H,6,9-10,13H2,1-2H3/t17-/m0/s1