actinium; [3-[[2-methyl-5-(phenylsulfonylamino)phenyl]amino]-3-oxidanylidene-propyl]azanide

Systemtic Name: actinium; [3-[[2-methyl-5-(phenylsulfonylamino)phenyl]amino]-3-oxidanylidene-propyl]azanide Openeye Name: actinium; [3-[5-(benzenesulfonamido)-2-methyl-anilino]-3-oxo-propyl]azanide CAS Name: actinium; [3-[5-(benzenesulfonamido)-2-methylanilino]-3-oxopropyl]azanide IUPAC Name: actinium; [3-[5-(benzenesulfonamido)-2-methylanilino]-3-oxopropyl]azanide Traditional Name: actinium; [3-[5-(benzenesulfonamido)-2-methyl-anilino]-3-keto-propyl]azanide Formula: C16H18AcN3O3S- MolecularWeight: 559.425167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)CC[NH-].[Ac]

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)CC[NH-].[Ac]

InChI

InChI=1S/C16H18N3O3S.Ac/c1-12-7-8-13(11-15(12)18-16(20)9-10-17)19-23(21,22)14-5-3-2-4-6-14;/h2-8,11,17,19H,9-10H2,1H3,(H,18,20);/q-1;