[3-(2-chloroethyl)-2-ethoxycarbonyl-1H-indol-7-yl]methanesulfonic acid

Systemtic Name: [3-(2-chloroethyl)-2-ethoxycarbonyl-1H-indol-7-yl]methanesulfonic acid Openeye Name: [3-(2-chloroethyl)-2-ethoxycarbonyl-1H-indol-7-yl]methanesulfonic acid CAS Name: [3-(2-chloroethyl)-2-ethoxycarbonyl-1H-indol-7-yl]methanesulfonic acid IUPAC Name: [3-(2-chloroethyl)-2-ethoxycarbonyl-1H-indol-7-yl]methanesulfonic acid Traditional Name: [2-carbethoxy-3-(2-chloroethyl)-1H-indol-7-yl]methanesulfonic acid Formula: C14H16ClNO5S MolecularWeight: 345.79854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C(=CC=C2)CS(=O)(=O)O)CCCl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C(=CC=C2)CS(=O)(=O)O)CCCl

InChI

InChI=1S/C14H16ClNO5S/c1-2-21-14(17)13-11(6-7-15)10-5-3-4-9(12(10)16-13)8-22(18,19)20/h3-5,16H,2,6-8H2,1H3,(H,18,19,20)