(phenylmethyl) (2S)-2-[[3-(1H-indol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[3-(1H-indol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[3-(1H-indol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[3-(1H-indol-4-yl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[3-(1H-indol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[3-(1H-indol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C27H25N3O3 MolecularWeight: 439.5057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4=C5C=CNC5=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4=C5C=CNC5=CC=C4

InChI

InChI=1S/C27H25N3O3/c31-26(25-13-6-16-30(25)27(32)33-18-19-7-2-1-3-8-19)29-21-10-4-9-20(17-21)22-11-5-12-24-23(22)14-15-28-24/h1-5,7-12,14-15,17,25,28H,6,13,16,18H2,(H,29,31)/t25-/m0/s1