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

Systemtic Name: 5-(2-butylpiperidin-1-yl)-2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]cyclohexa-2,4-dien-1-imine Openeye Name: 5-(2-butyl-1-piperidyl)-2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]cyclohexa-2,4-dien-1-imine CAS Name: 5-(2-butyl-1-piperidinyl)-2-[(1-methyl-5-nitro-2-imidazolyl)methoxy]-1-cyclohexa-2,4-dienimine IUPAC Name: 5-(2-butylpiperidin-1-yl)-2-[(1-methyl-5-nitroimidazol-2-yl)methoxy]cyclohexa-2,4-dien-1-imine Traditional Name: [5-(2-butylpiperidino)-2-[(1-methyl-5-nitro-imidazol-2-yl)methoxy]cyclohexa-2,4-dien-1-ylidene]amine Formula: C20H29N5O3 MolecularWeight: 387.47596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCCCN1C2=CC=C(C(=N)C2)OCC3=NC=C(N3C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1CCCCN1C2=CC=C(C(=N)C2)OCC3=NC=C(N3C)[N+](=O)[O-]

InChI

InChI=1S/C20H29N5O3/c1-3-4-7-15-8-5-6-11-24(15)16-9-10-18(17(21)12-16)28-14-19-22-13-20(23(19)2)25(26)27/h9-10,13,15,21H,3-8,11-12,14H2,1-2H3