(phenylmethyl) (2S)-2-[[3-(1H-indol-5-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[3-(1H-indol-5-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[3-(1H-indol-5-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[3-(1H-indol-5-yl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[3-(1H-indol-5-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[3-(1H-indol-5-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4=CC5=C(C=C4)NC=C5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C4=CC5=C(C=C4)NC=C5

InChI

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