2-[[7-[4-(3-methoxyphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol

Systemtic Name: 2-[[7-[4-(3-methoxyphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol Openeye Name: 2-[[7-[4-(3-methoxyphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol CAS Name: 2-[[7-[4-(3-methoxyphenyl)-1-piperazinyl]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methylamino]ethanol IUPAC Name: 2-[[7-[4-(3-methoxyphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]-methylamino]ethanol Traditional Name: 2-[[7-[4-(3-methoxyphenyl)piperazino]-4-nitro-benzofurazan-5-yl]-methyl-amino]ethanol Formula: C20H24N6O5 MolecularWeight: 428.44176

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)C1=C(C2=NON=C2C(=C1)N3CCN(CC3)C4=CC(=CC=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CCO)C1=C(C2=NON=C2C(=C1)N3CCN(CC3)C4=CC(=CC=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O5/c1-23(10-11-27)17-13-16(18-19(22-31-21-18)20(17)26(28)29)25-8-6-24(7-9-25)14-4-3-5-15(12-14)30-2/h3-5,12-13,27H,6-11H2,1-2H3