2-[2-(dimethylaminomethyl)pyrrolidin-1-yl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-[2-(dimethylaminomethyl)pyrrolidin-1-yl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 2-[2-(dimethylaminomethyl)pyrrolidin-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 2-[2-(dimethylaminomethyl)-1-pyrrolidinyl]-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 2-[2-(dimethylaminomethyl)pyrrolidin-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 2-[2-(dimethylaminomethyl)pyrrolidino]-4-keto-1H-quinoline-3-carboxylic acid Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCN1C2=C(C(=O)C3=CC=CC=C3N2)C(=O)O

Isomeric SMILES

CN(C)CC1CCCN1C2=C(C(=O)C3=CC=CC=C3N2)C(=O)O

InChI

InChI=1S/C17H21N3O3/c1-19(2)10-11-6-5-9-20(11)16-14(17(22)23)15(21)12-7-3-4-8-13(12)18-16/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,18,21)(H,22,23)