N-[4-(acridin-10-ium-9-ylamino)-3-methoxy-phenyl]methanesulfonamide

Systemtic Name: N-[4-(acridin-10-ium-9-ylamino)-3-methoxy-phenyl]methanesulfonamide Openeye Name: N-[4-(acridin-10-ium-9-ylamino)-3-methoxy-phenyl]methanesulfonamide CAS Name: N-[4-(9-acridin-10-iumylamino)-3-methoxyphenyl]methanesulfonamide IUPAC Name: N-[4-(acridin-10-ium-9-ylamino)-3-methoxyphenyl]methanesulfonamide Traditional Name: N-[4-(acridin-10-ium-9-ylamino)-3-methoxy-phenyl]methanesulfonamide Formula: C21H20N3O3S+ MolecularWeight: 394.4668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=[NH+]C4=CC=CC=C42

Isomeric SMILES

COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=[NH+]C4=CC=CC=C42

InChI

InChI=1S/C21H19N3O3S/c1-27-20-13-14(24-28(2,25)26)11-12-19(20)23-21-15-7-3-5-9-17(15)22-18-10-6-4-8-16(18)21/h3-13,24H,1-2H3,(H,22,23)/p+1