2-[4-[4-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-2-yl]piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-[4-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-2-yl]piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-[4-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-2-yl]piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-[4-[4-(4-nitrophenyl)-1-piperazinyl]-2-quinazolinyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-[4-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-2-yl]piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-[4-[4-(4-nitrophenyl)piperazino]quinazolin-2-yl]piperazin-1-ium-1-yl]ethanol Formula: C24H30N7O3+ MolecularWeight: 464.5401

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=NC3=CC=CC=C3C(=N2)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=NC3=CC=CC=C3C(=N2)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H29N7O3/c32-18-17-27-9-11-30(12-10-27)24-25-22-4-2-1-3-21(22)23(26-24)29-15-13-28(14-16-29)19-5-7-20(8-6-19)31(33)34/h1-8,32H,9-18H2/p+1