8-(5-azanyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-(5-azanyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-cyclopropyl-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-cyclopropyl-7-fluoro-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C23H22FN3O3 MolecularWeight: 407.437483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4CCC5=C(C4)C=CC=C5N

Isomeric SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4CCC5=C(C4)C=CC=C5N

InChI

InChI=1S/C23H22FN3O3/c1-12-20-16(13-5-6-13)9-17(23(29)30)22(28)27(20)11-18(24)21(12)26-8-7-15-14(10-26)3-2-4-19(15)25/h2-4,9,11,13H,5-8,10,25H2,1H3,(H,29,30)