1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-methyl-pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-methyl-pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-methyl-pyrrolidin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-methyl-1-pyrrolidinyl]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-methylpyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-methyl-pyrrolidino]-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H25F2N3O3 MolecularWeight: 405.438306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F)CN(C)C

Isomeric SMILES

CC1(CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F)CN(C)C

InChI

InChI=1S/C21H25F2N3O3/c1-21(10-24(2)3)6-7-25(11-21)18-15(22)8-13-17(16(18)23)26(12-4-5-12)9-14(19(13)27)20(28)29/h8-9,12H,4-7,10-11H2,1-3H3,(H,28,29)