1-cyclopropyl-6,8-bis(fluoranyl)-3-(2-nitroethanoyl)-7-piperazin-1-yl-quinolin-4-one hydrochloride

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-3-(2-nitroethanoyl)-7-piperazin-1-yl-quinolin-4-one hydrochloride Openeye Name: 1-cyclopropyl-6,8-difluoro-3-(2-nitroacetyl)-7-piperazin-1-yl-quinolin-4-one hydrochloride CAS Name: 1-cyclopropyl-6,8-difluoro-3-(2-nitro-1-oxoethyl)-7-(1-piperazinyl)-4-quinolinone hydrochloride IUPAC Name: 1-cyclopropyl-6,8-difluoro-3-(2-nitroacetyl)-7-piperazin-1-ylquinolin-4-one hydrochloride Traditional Name: 1-cyclopropyl-6,8-difluoro-3-(2-nitroacetyl)-7-piperazino-4-quinolone hydrochloride Formula: C18H19ClF2N4O4 MolecularWeight: 428.817666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)N4CCNCC4)F)C(=O)C[N+](=O)[O-].Cl

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)N4CCNCC4)F)C(=O)C[N+](=O)[O-].Cl

InChI

InChI=1S/C18H18F2N4O4.ClH/c19-13-7-11-16(15(20)17(13)22-5-3-21-4-6-22)23(10-1-2-10)8-12(18(11)26)14(25)9-24(27)28;/h7-8,10,21H,1-6,9H2;1H