(1R)-2-azaniumyl-1-(1-ethanoylindol-3-yl)ethanesulfonate

Systemtic Name: (1R)-2-azaniumyl-1-(1-ethanoylindol-3-yl)ethanesulfonate Openeye Name: (1R)-1-(1-acetylindol-3-yl)-2-azaniumyl-ethanesulfonate CAS Name: (1R)-1-(1-acetyl-3-indolyl)-2-ammonioethanesulfonate IUPAC Name: (1R)-1-(1-acetylindol-3-yl)-2-azaniumylethanesulfonate Traditional Name: (1R)-1-(1-acetylindol-3-yl)-2-ammonio-ethanesulfonate Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=CC=CC=C21)C(C[NH3+])S(=O)(=O)[O-]

Isomeric SMILES

CC(=O)N1C=C(C2=CC=CC=C21)[C@H](C[NH3+])S(=O)(=O)[O-]

InChI

InChI=1S/C12H14N2O4S/c1-8(15)14-7-10(12(6-13)19(16,17)18)9-4-2-3-5-11(9)14/h2-5,7,12H,6,13H2,1H3,(H,16,17,18)/t12-/m0/s1