tert-butyl carbamate; 1-cyclopropyl-8-ethoxy-3-ethyl-6-fluoranyl-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid

Systemtic Name: tert-butyl carbamate; 1-cyclopropyl-8-ethoxy-3-ethyl-6-fluoranyl-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Openeye Name: tert-butyl carbamate; 1-cyclopropyl-8-ethoxy-3-ethyl-6-fluoro-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid CAS Name: carbamic acid tert-butyl ester; 1-cyclopropyl-8-ethoxy-3-ethyl-6-fluoro-4-oxo-2-(1-pyrrolidinyl)-2H-quinoline-3-carboxylic acid IUPAC Name: tert-butyl carbamate; 1-cyclopropyl-8-ethoxy-3-ethyl-6-fluoro-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Traditional Name: carbamic acid tert-butyl ester; 1-cyclopropyl-8-ethoxy-3-ethyl-6-fluoro-4-keto-2-pyrrolidino-2H-quinoline-3-carboxylic acid Formula: C26H38FN3O6 MolecularWeight: 507.594823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C2=C(C=C(C=C2C1=O)F)OCC)C3CC3)N4CCCC4)C(=O)O.CC(C)(C)OC(=O)N

Isomeric SMILES

CCC1(C(N(C2=C(C=C(C=C2C1=O)F)OCC)C3CC3)N4CCCC4)C(=O)O.CC(C)(C)OC(=O)N

InChI

InChI=1S/C21H27FN2O4.C5H11NO2/c1-3-21(20(26)27)18(25)15-11-13(22)12-16(28-4-2)17(15)24(14-7-8-14)19(21)23-9-5-6-10-23;1-5(2,3)8-4(6)7/h11-12,14,19H,3-10H2,1-2H3,(H,26,27);1-3H3,(H2,6,7)