1-ethyl-8-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanylidene-2-pyrrolidin-1-yl-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 1-ethyl-8-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanylidene-2-pyrrolidin-1-yl-quinolin-1-ium-3-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-1-ethyl-8-methoxy-4-oxo-2-pyrrolidin-1-yl-quinolin-1-ium-3-carboxylic acid CAS Name: 1-ethyl-8-methoxy-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-oxo-2-(1-pyrrolidinyl)-3-quinolin-1-iumcarboxylic acid IUPAC Name: 1-ethyl-8-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxo-2-pyrrolidin-1-ylquinolin-1-ium-3-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-1-ethyl-4-keto-8-methoxy-2-pyrrolidino-quinolin-1-ium-3-carboxylic acid Formula: C22H29N2O6+ MolecularWeight: 417.47546

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C2=C(C=CC=C2OC)C(=O)C(=C1N3CCCC3)C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC[N+]1(C2=C(C=CC=C2OC)C(=O)C(=C1N3CCCC3)C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H28N2O6/c1-6-24(21(28)30-22(2,3)4)17-14(10-9-11-15(17)29-5)18(25)16(20(26)27)19(24)23-12-7-8-13-23/h9-11H,6-8,12-13H2,1-5H3/p+1