1-[3-[4-(3-azanylpropyl)piperazin-1-yl]propylamino]-7-fluoranyl-4-nitro-10H-acridin-9-one

Systemtic Name: 1-[3-[4-(3-azanylpropyl)piperazin-1-yl]propylamino]-7-fluoranyl-4-nitro-10H-acridin-9-one Openeye Name: 1-[3-[4-(3-aminopropyl)piperazin-1-yl]propylamino]-7-fluoro-4-nitro-10H-acridin-9-one CAS Name: 1-[3-[4-(3-aminopropyl)-1-piperazinyl]propylamino]-7-fluoro-4-nitro-10H-acridin-9-one IUPAC Name: 1-[3-[4-(3-aminopropyl)piperazin-1-yl]propylamino]-7-fluoro-4-nitro-10H-acridin-9-one Traditional Name: 1-[3-[4-(3-aminopropyl)piperazino]propylamino]-7-fluoro-4-nitro-10H-acridin-9-one Formula: C23H29FN6O3 MolecularWeight: 456.513163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN)CCCNC2=C3C(=C(C=C2)[N+](=O)[O-])NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCCN)CCCNC2=C3C(=C(C=C2)[N+](=O)[O-])NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C23H29FN6O3/c24-16-3-4-18-17(15-16)23(31)21-19(5-6-20(30(32)33)22(21)27-18)26-8-2-10-29-13-11-28(12-14-29)9-1-7-25/h3-6,15,26H,1-2,7-14,25H2,(H,27,31)