2-ethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxamide

Systemtic Name: 2-ethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxamide Openeye Name: 2-ethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxamide CAS Name: 2-ethyl-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxamide IUPAC Name: 2-ethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxamide Traditional Name: 2-ethyl-N-(4-pyrrolidinosulfonylphenyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxamide Formula: C25H29N4O3S+ MolecularWeight: 465.58776

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC[NH+]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H28N4O3S/c1-2-28-16-13-23-21(17-28)24(20-7-3-4-8-22(20)27-23)25(30)26-18-9-11-19(12-10-18)33(31,32)29-14-5-6-15-29/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,26,30)/p+1