2,6-bis[(4-methylpiperazin-1-yl)methyl]-4-nitro-phenol

Systemtic Name: 2,6-bis[(4-methylpiperazin-1-yl)methyl]-4-nitro-phenol Openeye Name: 2,6-bis[(4-methylpiperazin-1-yl)methyl]-4-nitro-phenol CAS Name: 2,6-bis[(4-methyl-1-piperazinyl)methyl]-4-nitrophenol IUPAC Name: 2,6-bis[(4-methylpiperazin-1-yl)methyl]-4-nitrophenol Traditional Name: 2,6-bis[(4-methylpiperazino)methyl]-4-nitro-phenol Formula: C18H29N5O3 MolecularWeight: 363.45456

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H29N5O3/c1-19-3-7-21(8-4-19)13-15-11-17(23(25)26)12-16(18(15)24)14-22-9-5-20(2)6-10-22/h11-12,24H,3-10,13-14H2,1-2H3