3-(2-fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-(2-fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-(2-fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-(2-fluorophenyl)-2-[(4-methyl-1-piperazinyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-(2-fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(2-fluorophenyl)-2-[(4-methylpiperazino)methyl]-6-nitro-quinazolin-4-one Formula: C20H20FN5O3 MolecularWeight: 397.402903

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4F

Isomeric SMILES

CN1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4F

InChI

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