N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-benzyl-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-benzyl-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-benzyl-N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C25H30N3O2+ MolecularWeight: 404.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=O)C[NH+]4CCCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=O)C[NH+]4CCCC4)C

InChI

InChI=1S/C25H29N3O2/c1-18-10-11-21-14-22(25(30)26-24(21)19(18)2)16-28(15-20-8-4-3-5-9-20)23(29)17-27-12-6-7-13-27/h3-5,8-11,14H,6-7,12-13,15-17H2,1-2H3,(H,26,30)/p+1