(2Z)-5-ethoxy-6-ethyl-2-[4-nitro-2-(oxan-2-yl)-1H-pyrazol-5-ylidene]benzimidazole

Systemtic Name: (2Z)-5-ethoxy-6-ethyl-2-[4-nitro-2-(oxan-2-yl)-1H-pyrazol-5-ylidene]benzimidazole Openeye Name: (2Z)-5-ethoxy-6-ethyl-2-(4-nitro-2-tetrahydropyran-2-yl-1H-pyrazol-5-ylidene)benzimidazole CAS Name: (2Z)-5-ethoxy-6-ethyl-2-[4-nitro-2-(2-oxanyl)-1H-pyrazol-5-ylidene]benzimidazole IUPAC Name: (2Z)-5-ethoxy-6-ethyl-2-[4-nitro-2-(oxan-2-yl)-1H-pyrazol-5-ylidene]benzimidazole Traditional Name: (2Z)-5-ethoxy-6-ethyl-2-(4-nitro-1-tetrahydropyran-2-yl-3-pyrazolin-3-ylidene)benzimidazole Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=NC(=C3C(=CN(N3)C4CCCCO4)[N+](=O)[O-])N=C2C=C1OCC

Isomeric SMILES

CCC1=CC2=N/C(=C/3\C(=CN(N3)C4CCCCO4)[N+](=O)[O-])/N=C2C=C1OCC

InChI

InChI=1S/C19H23N5O4/c1-3-12-9-13-14(10-16(12)27-4-2)21-19(20-13)18-15(24(25)26)11-23(22-18)17-7-5-6-8-28-17/h9-11,17,22H,3-8H2,1-2H3/b19-18-