N-ethyl-6-(3-morpholin-4-ium-4-ylpropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-(3-morpholin-4-ium-4-ylpropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-(3-morpholin-4-ium-4-ylpropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[3-(4-morpholin-4-iumyl)propylamino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-(3-morpholin-4-ium-4-ylpropylamino)-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-(3-morpholin-4-ium-4-ylpropylamino)-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C20H30N4O3S+2 MolecularWeight: 406.5422

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC[NH+]3CCOCC3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C20H28N4O3S/c1-2-24(18-7-4-3-5-8-18)28(25,26)19-9-10-20(22-17-19)21-11-6-12-23-13-15-27-16-14-23/h3-5,7-10,17H,2,6,11-16H2,1H3,(H,21,22)/p+2