1-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-2-piperazin-1-yl-ethanol

Systemtic Name: 1-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-2-piperazin-1-yl-ethanol Openeye Name: 1-(2-benzyloxy-5-methyl-3-nitro-phenyl)-2-piperazin-1-yl-ethanol CAS Name: 1-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-2-(1-piperazinyl)ethanol IUPAC Name: 1-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-2-piperazin-1-ylethanol Traditional Name: 1-(2-benzoxy-5-methyl-3-nitro-phenyl)-2-piperazino-ethanol Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])OCC2=CC=CC=C2)C(CN3CCNCC3)O

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])OCC2=CC=CC=C2)C(CN3CCNCC3)O

InChI

InChI=1S/C20H25N3O4/c1-15-11-17(19(24)13-22-9-7-21-8-10-22)20(18(12-15)23(25)26)27-14-16-5-3-2-4-6-16/h2-6,11-12,19,21,24H,7-10,13-14H2,1H3