2-[2-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]sulfonylethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)indol-3-yl]sulfonylethanoylamino]ethanoic acid Openeye Name: 2-[[2-[1-[2-oxo-2-(1-piperidyl)ethyl]indol-3-yl]sulfonylacetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-[[1-[2-oxo-2-(1-piperidinyl)ethyl]-3-indolyl]sulfonyl]ethyl]amino]acetic acid IUPAC Name: 2-[[2-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]sulfonylacetyl]amino]acetic acid Traditional Name: 2-[[2-[1-(2-keto-2-piperidino-ethyl)indol-3-yl]sulfonylacetyl]amino]acetic acid Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC(=O)NCC(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC(=O)NCC(=O)O

InChI

InChI=1S/C19H23N3O6S/c23-17(20-10-19(25)26)13-29(27,28)16-11-22(15-7-3-2-6-14(15)16)12-18(24)21-8-4-1-5-9-21/h2-3,6-7,11H,1,4-5,8-10,12-13H2,(H,20,23)(H,25,26)