7-chloranyl-2-methyl-1-[3-(sulfonylamino)propyl]indole-3-carboxylic acid; methane

Systemtic Name: 7-chloranyl-2-methyl-1-[3-(sulfonylamino)propyl]indole-3-carboxylic acid; methane Openeye Name: 7-chloro-2-methyl-1-[3-(sulfonylamino)propyl]indole-3-carboxylic acid; methane CAS Name: 7-chloro-2-methyl-1-[3-(sulfonylamino)propyl]-3-indolecarboxylic acid; methane IUPAC Name: 7-chloro-2-methyl-1-[3-(sulfonylamino)propyl]indole-3-carboxylic acid; methane Traditional Name: 7-chloro-2-methyl-1-[3-(sulfonylamino)propyl]indole-3-carboxylic acid; methane Formula: C14H17ClN2O4S MolecularWeight: 344.81378

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Descriptors Computed from Structure

Canonical SMILES:

C.CC1=C(C2=C(N1CCCN=S(=O)=O)C(=CC=C2)Cl)C(=O)O

Isomeric SMILES

C.CC1=C(C2=C(N1CCCN=S(=O)=O)C(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C13H13ClN2O4S.CH4/c1-8-11(13(17)18)9-4-2-5-10(14)12(9)16(8)7-3-6-15-21(19)20;/h2,4-5H,3,6-7H2,1H3,(H,17,18);1H4