N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)-3-phenyl-propanamide

Systemtic Name: N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)-3-phenyl-propanamide Openeye Name: N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)-3-phenyl-propanamide CAS Name: N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)-3-phenylpropanamide IUPAC Name: N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)-3-phenylpropanamide Traditional Name: N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)-3-phenyl-propionamide Formula: C21H22N3O+ MolecularWeight: 332.41888

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C3=CC=CC=C3[NH+]=C21)NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CN1CCC2=C(C3=CC=CC=C3[NH+]=C21)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O/c1-24-14-13-17-20(16-9-5-6-10-18(16)22-21(17)24)23-19(25)12-11-15-7-3-2-4-8-15/h2-10H,11-14H2,1H3,(H,22,23,25)/p+1