7-(2-azanylpropanoylamino)-1-cyclopropyl-6-fluoranyl-3,5-dimethyl-4-oxidanylidene-2-pyrrolidin-1-yl-2H-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 7-(2-azanylpropanoylamino)-1-cyclopropyl-6-fluoranyl-3,5-dimethyl-4-oxidanylidene-2-pyrrolidin-1-yl-2H-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-(2-aminopropanoylamino)-1-cyclopropyl-6-fluoro-3,5-dimethyl-4-oxo-2-pyrrolidin-1-yl-2H-1,8-naphthyridine-3-carboxylic acid CAS Name: 7-[(2-amino-1-oxopropyl)amino]-1-cyclopropyl-6-fluoro-3,5-dimethyl-4-oxo-2-(1-pyrrolidinyl)-2H-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-(2-aminopropanoylamino)-1-cyclopropyl-6-fluoro-3,5-dimethyl-4-oxo-2-pyrrolidin-1-yl-2H-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-(alanylamino)-1-cyclopropyl-6-fluoro-4-keto-3,5-dimethyl-2-pyrrolidino-2H-1,8-naphthyridine-3-carboxylic acid Formula: C21H28FN5O4 MolecularWeight: 433.476523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=O)C(C(N(C2=NC(=C1F)NC(=O)C(C)N)C3CC3)N4CCCC4)(C)C(=O)O

Isomeric SMILES

CC1=C2C(=O)C(C(N(C2=NC(=C1F)NC(=O)C(C)N)C3CC3)N4CCCC4)(C)C(=O)O

InChI

InChI=1S/C21H28FN5O4/c1-10-13-15(28)21(3,20(30)31)19(26-8-4-5-9-26)27(12-6-7-12)17(13)24-16(14(10)22)25-18(29)11(2)23/h11-12,19H,4-9,23H2,1-3H3,(H,30,31)(H,24,25,29)