7-[(3S)-3-azanylpyrrolidin-1-yl]-8-chloranyl-1-cyclopropyl-6-fluoranyl-3-(2-nitroethanoyl)quinolin-4-one hydrochloride

Systemtic Name: 7-[(3S)-3-azanylpyrrolidin-1-yl]-8-chloranyl-1-cyclopropyl-6-fluoranyl-3-(2-nitroethanoyl)quinolin-4-one hydrochloride Openeye Name: 7-[(3S)-3-aminopyrrolidin-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-3-(2-nitroacetyl)quinolin-4-one hydrochloride CAS Name: 7-[(3S)-3-amino-1-pyrrolidinyl]-8-chloro-1-cyclopropyl-6-fluoro-3-(2-nitro-1-oxoethyl)-4-quinolinone hydrochloride IUPAC Name: 7-[(3S)-3-aminopyrrolidin-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-3-(2-nitroacetyl)quinolin-4-one hydrochloride Traditional Name: 7-[(3S)-3-aminopyrrolidino]-8-chloro-1-cyclopropyl-6-fluoro-3-(2-nitroacetyl)-4-quinolone hydrochloride Formula: C18H19Cl2FN4O4 MolecularWeight: 445.272263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)N4CCC(C4)N)F)C(=O)C[N+](=O)[O-].Cl

Isomeric SMILES

C1CN(C[C@H]1N)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)C[N+](=O)[O-])C4CC4)F.Cl

InChI

InChI=1S/C18H18ClFN4O4.ClH/c19-15-16-11(5-13(20)17(15)22-4-3-9(21)6-22)18(26)12(14(25)8-24(27)28)7-23(16)10-1-2-10;/h5,7,9-10H,1-4,6,8,21H2;1H/t9-;/m0./s1