N-[1-(phenylmethyl)-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl]butanamide

Systemtic Name: N-[1-(phenylmethyl)-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl]butanamide Openeye Name: N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)butanamide CAS Name: N-[1-(phenylmethyl)-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl]butanamide IUPAC Name: N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)butanamide Traditional Name: N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-9-ium-4-yl)butyramide Formula: C22H24N3O+ MolecularWeight: 346.44546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C2CCN(C2=[NH+]C3=CC=CC=C31)CC4=CC=CC=C4

Isomeric SMILES

CCCC(=O)NC1=C2CCN(C2=[NH+]C3=CC=CC=C31)CC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O/c1-2-8-20(26)24-21-17-11-6-7-12-19(17)23-22-18(21)13-14-25(22)15-16-9-4-3-5-10-16/h3-7,9-12H,2,8,13-15H2,1H3,(H,23,24,26)/p+1