[(2S)-3-azanyl-2-(phenylsulfonylamino)propanoyl] 5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxylate

Systemtic Name: [(2S)-3-azanyl-2-(phenylsulfonylamino)propanoyl] 5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxylate Openeye Name: [(2S)-3-amino-2-(benzenesulfonamido)propanoyl] 5-(4-piperidylmethoxy)-1H-indole-2-carboxylate CAS Name: 5-(4-piperidinylmethoxy)-1H-indole-2-carboxylic acid [(2S)-3-amino-2-(benzenesulfonamido)-1-oxopropyl] ester IUPAC Name: [(2S)-3-amino-2-(benzenesulfonamido)propanoyl] 5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxylate Traditional Name: 5-(4-piperidylmethoxy)-1H-indole-2-carboxylic acid [(2S)-3-amino-2-(benzenesulfonamido)propanoyl] ester Formula: C24H28N4O6S MolecularWeight: 500.56732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1COC2=CC3=C(C=C2)NC(=C3)C(=O)OC(=O)C(CN)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCCC1COC2=CC3=C(C=C2)NC(=C3)C(=O)OC(=O)[C@H](CN)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O6S/c25-14-22(28-35(31,32)19-4-2-1-3-5-19)24(30)34-23(29)21-13-17-12-18(6-7-20(17)27-21)33-15-16-8-10-26-11-9-16/h1-7,12-13,16,22,26-28H,8-11,14-15,25H2/t22-/m0/s1