(phenylmethyl) (2S)-2-[6-(1H-indol-7-yl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[6-(1H-indol-7-yl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[6-(1H-indol-7-yl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[6-(1H-indol-7-yl)-1H-benzimidazol-2-yl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[6-(1H-indol-7-yl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[6-(1H-indol-7-yl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=CC6=C5NC=C6

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=CC6=C5NC=C6

InChI

InChI=1S/C27H24N4O2/c32-27(33-17-18-6-2-1-3-7-18)31-15-5-10-24(31)26-29-22-12-11-20(16-23(22)30-26)21-9-4-8-19-13-14-28-25(19)21/h1-4,6-9,11-14,16,24,28H,5,10,15,17H2,(H,29,30)/t24-/m0/s1