4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Openeye Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole CAS Name: 4-[4-(4-nitrophenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole IUPAC Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole Traditional Name: 4-[4-(4-nitrophenyl)piperazino]-5H-pyrimid[5,4-b]indole Formula: C20H18N6O2 MolecularWeight: 374.39592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=NC4=C3NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=NC4=C3NC5=CC=CC=C54

InChI

InChI=1S/C20H18N6O2/c27-26(28)15-7-5-14(6-8-15)24-9-11-25(12-10-24)20-19-18(21-13-22-20)16-3-1-2-4-17(16)23-19/h1-8,13,23H,9-12H2