N-(3-indol-1-ylpropyl)-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-(3-indol-1-ylpropyl)-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-(3-indol-1-ylpropyl)-5-morpholinosulfonyl-pyridin-1-ium-2-amine CAS Name: N-[3-(1-indolyl)propyl]-5-(4-morpholinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-(3-indol-1-ylpropyl)-5-morpholin-4-ylsulfonylpyridin-1-ium-2-amine Traditional Name: 3-indol-1-ylpropyl-(5-morpholinosulfonylpyridin-1-ium-2-yl)amine Formula: C20H25N4O3S+ MolecularWeight: 401.5025

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C[NH+]=C(C=C2)NCCCN3C=CC4=CC=CC=C43

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C[NH+]=C(C=C2)NCCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C20H24N4O3S/c25-28(26,24-12-14-27-15-13-24)18-6-7-20(22-16-18)21-9-3-10-23-11-8-17-4-1-2-5-19(17)23/h1-2,4-8,11,16H,3,9-10,12-15H2,(H,21,22)/p+1