methanesulfonic acid; 2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: methanesulfonic acid; 2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridine Openeye Name: methanesulfonic acid; 2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridine CAS Name: methanesulfonic acid; 2-(5-methoxy-1-methyl-3-indolyl)-1H-pyrrolo[2,3-b]pyridine IUPAC Name: methanesulfonic acid; 2-(5-methoxy-1-methylindol-3-yl)-1H-pyrrolo[2,3-b]pyridine Traditional Name: mesylic acid; 2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridine Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=C(N3)N=CC=C4.CS(=O)(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=C(N3)N=CC=C4.CS(=O)(=O)O

InChI

InChI=1S/C17H15N3O.CH4O3S/c1-20-10-14(13-9-12(21-2)5-6-16(13)20)15-8-11-4-3-7-18-17(11)19-15;1-5(2,3)4/h3-10H,1-2H3,(H,18,19);1H3,(H,2,3,4)