7-[3-[(2-azanylethanoylamino)methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-[(2-azanylethanoylamino)methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[[(2-aminoacetyl)amino]methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[[(2-amino-1-oxoethyl)amino]methyl]-3-methyl-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-[[(2-aminoacetyl)amino]methyl]-3-methylpyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[3-[(glycylamino)methyl]-3-methyl-pyrrolidino]-4-keto-quinoline-3-carboxylic acid Formula: C21H25FN4O4 MolecularWeight: 416.446003

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)CNC(=O)CN

Isomeric SMILES

CC1(CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)CNC(=O)CN

InChI

InChI=1S/C21H25FN4O4/c1-21(10-24-18(27)8-23)4-5-25(11-21)17-7-16-13(6-15(17)22)19(28)14(20(29)30)9-26(16)12-2-3-12/h6-7,9,12H,2-5,8,10-11,23H2,1H3,(H,24,27)(H,29,30)