6-oxidanylidene-N-(2-piperidin-1-ium-1-ylethyl)-5H-phenanthridine-2-sulfonamide chloride

Systemtic Name: 6-oxidanylidene-N-(2-piperidin-1-ium-1-ylethyl)-5H-phenanthridine-2-sulfonamide chloride Openeye Name: 6-oxo-N-(2-piperidin-1-ium-1-ylethyl)-5H-phenanthridine-2-sulfonamide chloride CAS Name: 6-oxo-N-[2-(1-piperidin-1-iumyl)ethyl]-5H-phenanthridine-2-sulfonamide chloride IUPAC Name: 6-oxo-N-(2-piperidin-1-ium-1-ylethyl)-5H-phenanthridine-2-sulfonamide chloride Traditional Name: 6-keto-N-(2-piperidin-1-ium-1-ylethyl)-5H-phenanthridine-2-sulfonamide chloride Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C4=CC=CC=C43.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C4=CC=CC=C43.[Cl-]

InChI

InChI=1S/C20H23N3O3S.ClH/c24-20-17-7-3-2-6-16(17)18-14-15(8-9-19(18)22-20)27(25,26)21-10-13-23-11-4-1-5-12-23;/h2-3,6-9,14,21H,1,4-5,10-13H2,(H,22,24);1H