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

Systemtic Name: 2-[3-methoxy-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 2-[3-methoxy-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 2-[3-methoxy-3-(methylaminomethyl)-1-pyrrolidinyl]-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 2-[3-methoxy-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 4-keto-2-[3-methoxy-3-(methylaminomethyl)pyrrolidino]-1H-quinoline-3-carboxylic acid Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1(CCN(C1)C2=C(C(=O)C3=CC=CC=C3N2)C(=O)O)OC

Isomeric SMILES

CNCC1(CCN(C1)C2=C(C(=O)C3=CC=CC=C3N2)C(=O)O)OC

InChI

InChI=1S/C17H21N3O4/c1-18-9-17(24-2)7-8-20(10-17)15-13(16(22)23)14(21)11-5-3-4-6-12(11)19-15/h3-6,18H,7-10H2,1-2H3,(H,19,21)(H,22,23)