1-methyl-5-piperidin-1-ylsulfonyl-indole-2-carboxylic acid

Systemtic Name: 1-methyl-5-piperidin-1-ylsulfonyl-indole-2-carboxylic acid Openeye Name: 1-methyl-5-(1-piperidylsulfonyl)indole-2-carboxylic acid CAS Name: 1-methyl-5-(1-piperidinylsulfonyl)-2-indolecarboxylic acid IUPAC Name: 1-methyl-5-piperidin-1-ylsulfonylindole-2-carboxylic acid Traditional Name: 1-methyl-5-piperidinosulfonyl-indole-2-carboxylic acid Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C=C1C(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C=C1C(=O)O

InChI

InChI=1S/C15H18N2O4S/c1-16-13-6-5-12(9-11(13)10-14(16)15(18)19)22(20,21)17-7-3-2-4-8-17/h5-6,9-10H,2-4,7-8H2,1H3,(H,18,19)