acridin-9-yl-(3-methoxyphenyl)azanium; methanesulfonate

Systemtic Name: acridin-9-yl-(3-methoxyphenyl)azanium; methanesulfonate Openeye Name: acridin-9-yl-(3-methoxyphenyl)ammonium; methanesulfonate CAS Name: 9-acridinyl-(3-methoxyphenyl)ammonium; methanesulfonate IUPAC Name: acridin-9-yl-(3-methoxyphenyl)azanium; methanesulfonate Traditional Name: acridin-9-yl-(3-methoxyphenyl)ammonium mesylate Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)[NH2+]C2=C3C=CC=CC3=NC4=CC=CC=C42.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)[NH2+]C2=C3C=CC=CC3=NC4=CC=CC=C42.CS(=O)(=O)[O-]

InChI

InChI=1S/C20H16N2O.CH4O3S/c1-23-15-8-6-7-14(13-15)21-20-16-9-2-4-11-18(16)22-19-12-5-3-10-17(19)20;1-5(2,3)4/h2-13H,1H3,(H,21,22);1H3,(H,2,3,4)