7-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[4-[bis(4-fluorophenyl)methyl]piperazino]-6-nitro-1H-quinazolin-4-one Formula: C25H21F2N5O3 MolecularWeight: 477.462746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-])C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-])C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H21F2N5O3/c26-18-5-1-16(2-6-18)24(17-3-7-19(27)8-4-17)31-11-9-30(10-12-31)22-14-21-20(13-23(22)32(34)35)25(33)29-15-28-21/h1-8,13-15,24H,9-12H2,(H,28,29,33)