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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCCO

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C20H24N6O5/c1-30-17-6-3-2-5-15(17)24-8-10-25(11-9-24)16-13-14(21-7-4-12-27)20(26(28)29)19-18(16)22-31-23-19/h2-3,5-6,13,21,27H,4,7-12H2,1H3