4-(5-chloranyl-2-methyl-indol-1-yl)benzenesulfonic acid

Systemtic Name: 4-(5-chloranyl-2-methyl-indol-1-yl)benzenesulfonic acid Openeye Name: 4-(5-chloro-2-methyl-indol-1-yl)benzenesulfonic acid CAS Name: 4-(5-chloro-2-methyl-1-indolyl)benzenesulfonic acid IUPAC Name: 4-(5-chloro-2-methylindol-1-yl)benzenesulfonic acid Traditional Name: 4-(5-chloro-2-methyl-indol-1-yl)besylic acid Formula: C15H12ClNO3S MolecularWeight: 321.77868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C3=CC=C(C=C3)S(=O)(=O)O)C=CC(=C2)Cl

Isomeric SMILES

CC1=CC2=C(N1C3=CC=C(C=C3)S(=O)(=O)O)C=CC(=C2)Cl

InChI

InChI=1S/C15H12ClNO3S/c1-10-8-11-9-12(16)2-7-15(11)17(10)13-3-5-14(6-4-13)21(18,19)20/h2-9H,1H3,(H,18,19,20)