2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]-5-piperidin-1-yl-cyclohexa-2,4-dien-1-imine

Systemtic Name: 2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]-5-piperidin-1-yl-cyclohexa-2,4-dien-1-imine Openeye Name: 2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]-5-(1-piperidyl)cyclohexa-2,4-dien-1-imine CAS Name: 2-[(1-methyl-5-nitro-2-imidazolyl)methoxy]-5-(1-piperidinyl)-1-cyclohexa-2,4-dienimine IUPAC Name: 2-[(1-methyl-5-nitroimidazol-2-yl)methoxy]-5-piperidin-1-ylcyclohexa-2,4-dien-1-imine Traditional Name: [2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]-5-piperidino-cyclohexa-2,4-dien-1-ylidene]amine Formula: C16H21N5O3 MolecularWeight: 331.36964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC2=CC=C(CC2=N)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1COC2=CC=C(CC2=N)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O3/c1-19-15(18-10-16(19)21(22)23)11-24-14-6-5-12(9-13(14)17)20-7-3-2-4-8-20/h5-6,10,17H,2-4,7-9,11H2,1H3