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

Systemtic Name: [(3S)-3-azanyl-3-(phenylsulfonylamino)propanoyl] 5-(2-piperidin-4-ylethoxy)-1H-indole-2-carboxylate Openeye Name: [(3S)-3-amino-3-(benzenesulfonamido)propanoyl] 5-[2-(4-piperidyl)ethoxy]-1H-indole-2-carboxylate CAS Name: 5-[2-(4-piperidinyl)ethoxy]-1H-indole-2-carboxylic acid [(3S)-3-amino-3-(benzenesulfonamido)-1-oxopropyl] ester IUPAC Name: [(3S)-3-amino-3-(benzenesulfonamido)propanoyl] 5-(2-piperidin-4-ylethoxy)-1H-indole-2-carboxylate Traditional Name: 5-[2-(4-piperidyl)ethoxy]-1H-indole-2-carboxylic acid [(3S)-3-amino-3-(benzenesulfonamido)propanoyl] ester Formula: C25H30N4O6S MolecularWeight: 514.5939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCOC2=CC3=C(C=C2)NC(=C3)C(=O)OC(=O)CC(N)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCCC1CCOC2=CC3=C(C=C2)NC(=C3)C(=O)OC(=O)C[C@@H](N)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O6S/c26-23(29-36(32,33)20-4-2-1-3-5-20)16-24(30)35-25(31)22-15-18-14-19(6-7-21(18)28-22)34-13-10-17-8-11-27-12-9-17/h1-7,14-15,17,23,27-29H,8-13,16,26H2/t23-/m0/s1