methanesulfonate; (4-methoxyphenyl)-[1-(2-morpholin-4-ium-4-ylethyl)indol-3-yl]methanone

Systemtic Name: methanesulfonate; (4-methoxyphenyl)-[1-(2-morpholin-4-ium-4-ylethyl)indol-3-yl]methanone Openeye Name: methanesulfonate; (4-methoxyphenyl)-[1-(2-morpholin-4-ium-4-ylethyl)indol-3-yl]methanone CAS Name: methanesulfonate; (4-methoxyphenyl)-[1-[2-(4-morpholin-4-iumyl)ethyl]-3-indolyl]methanone IUPAC Name: methanesulfonate; (4-methoxyphenyl)-[1-(2-morpholin-4-ium-4-ylethyl)indol-3-yl]methanone Traditional Name: (4-methoxyphenyl)-[1-(2-morpholin-4-ium-4-ylethyl)indol-3-yl]methanone mesylate Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CN(C3=CC=CC=C32)CC[NH+]4CCOCC4.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CN(C3=CC=CC=C32)CC[NH+]4CCOCC4.CS(=O)(=O)[O-]

InChI

InChI=1S/C22H24N2O3.CH4O3S/c1-26-18-8-6-17(7-9-18)22(25)20-16-24(21-5-3-2-4-19(20)21)11-10-23-12-14-27-15-13-23;1-5(2,3)4/h2-9,16H,10-15H2,1H3;1H3,(H,2,3,4)