1-[3-[(4-methylphenyl)sulfonylamino]-1,4-bis(oxidanylidene)-2,3-dihydronaphthalen-2-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[3-[(4-methylphenyl)sulfonylamino]-1,4-bis(oxidanylidene)-2,3-dihydronaphthalen-2-yl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[1,4-dioxo-3-(p-tolylsulfonylamino)tetralin-2-yl]pyridin-1-ium-3-carboxamide CAS Name: 1-[3-[(4-methylphenyl)sulfonylamino]-1,4-dioxo-2,3-dihydronaphthalen-2-yl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[3-[(4-methylphenyl)sulfonylamino]-1,4-dioxo-2,3-dihydronaphthalen-2-yl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[1,4-diketo-3-(tosylamino)tetralin-2-yl]pyridin-1-ium-3-carboxamide Formula: C23H20N3O5S+ MolecularWeight: 450.487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC=CC(=C4)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C23H19N3O5S/c1-14-8-10-16(11-9-14)32(30,31)25-19-20(26-12-4-5-15(13-26)23(24)29)22(28)18-7-3-2-6-17(18)21(19)27/h2-13,19-20,25H,1H3,(H-,24,29)/p+1