1-cyclopropyl-7-[(cyclopropylamino)methyl]-6,8-bis(fluoranyl)-4-oxidanylidene-8,8a-dihydroquinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[(cyclopropylamino)methyl]-6,8-bis(fluoranyl)-4-oxidanylidene-8,8a-dihydroquinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[(cyclopropylamino)methyl]-6,8-difluoro-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[(cyclopropylamino)methyl]-6,8-difluoro-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid IUPAC Name: 1-cyclopropyl-7-[(cyclopropylamino)methyl]-6,8-difluoro-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[(cyclopropylamino)methyl]-6,8-difluoro-4-keto-8,8a-dihydroquinoline-3-carboxylic acid Formula: C17H18F2N2O3 MolecularWeight: 336.333226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC2=C(C=C3C(C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

C1CC1NCC2=C(C=C3C(C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C17H18F2N2O3/c18-13-5-10-15(14(19)11(13)6-20-8-1-2-8)21(9-3-4-9)7-12(16(10)22)17(23)24/h5,7-9,14-15,20H,1-4,6H2,(H,23,24)