1-(4-aminophenyl)-7-[(3S)-3-azanylpyrrolidin-1-yl]-6-fluoranyl-5-methyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-(4-aminophenyl)-7-[(3S)-3-azanylpyrrolidin-1-yl]-6-fluoranyl-5-methyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-(4-aminophenyl)-7-[(3S)-3-aminopyrrolidin-1-yl]-6-fluoro-5-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-(4-aminophenyl)-7-[(3S)-3-amino-1-pyrrolidinyl]-6-fluoro-5-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-(4-aminophenyl)-7-[(3S)-3-aminopyrrolidin-1-yl]-6-fluoro-5-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-(4-aminophenyl)-7-[(3S)-3-aminopyrrolidino]-6-fluoro-4-keto-5-methyl-1,8-naphthyridine-3-carboxylic acid Formula: C20H20FN5O3 MolecularWeight: 397.402903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=O)C(=CN(C2=NC(=C1F)N3CCC(C3)N)C4=CC=C(C=C4)N)C(=O)O

Isomeric SMILES

CC1=C2C(=O)C(=CN(C2=NC(=C1F)N3CC[C@@H](C3)N)C4=CC=C(C=C4)N)C(=O)O

InChI

InChI=1S/C20H20FN5O3/c1-10-15-17(27)14(20(28)29)9-26(13-4-2-11(22)3-5-13)18(15)24-19(16(10)21)25-7-6-12(23)8-25/h2-5,9,12H,6-8,22-23H2,1H3,(H,28,29)/t12-/m0/s1