2-methoxy-4-nitro-6-[[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]methyl]phenol

Systemtic Name: 2-methoxy-4-nitro-6-[[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]methyl]phenol Openeye Name: 2-methoxy-4-nitro-6-[[4-[1-(2-pyridylmethyl)imidazol-2-yl]-1-piperidyl]methyl]phenol CAS Name: 2-methoxy-4-nitro-6-[[4-[1-(2-pyridinylmethyl)-2-imidazolyl]-1-piperidinyl]methyl]phenol IUPAC Name: 2-methoxy-4-nitro-6-[[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]methyl]phenol Traditional Name: 2-methoxy-4-nitro-6-[[4-[1-(2-pyridylmethyl)imidazol-2-yl]piperidino]methyl]phenol Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)[N+](=O)[O-])CN2CCC(CC2)C3=NC=CN3CC4=CC=CC=N4)O

Isomeric SMILES

COC1=C(C(=CC(=C1)[N+](=O)[O-])CN2CCC(CC2)C3=NC=CN3CC4=CC=CC=N4)O

InChI

InChI=1S/C22H25N5O4/c1-31-20-13-19(27(29)30)12-17(21(20)28)14-25-9-5-16(6-10-25)22-24-8-11-26(22)15-18-4-2-3-7-23-18/h2-4,7-8,11-13,16,28H,5-6,9-10,14-15H2,1H3