N-(2,5-dimethylphenyl)-4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazol-5-amine

Systemtic Name: N-(2,5-dimethylphenyl)-4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazol-5-amine Openeye Name: N-(2,5-dimethylphenyl)-4-nitro-7-(1-piperidyl)-2,1,3-benzoxadiazol-5-amine CAS Name: N-(2,5-dimethylphenyl)-4-nitro-7-(1-piperidinyl)-2,1,3-benzoxadiazol-5-amine IUPAC Name: N-(2,5-dimethylphenyl)-4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazol-5-amine Traditional Name: (2,5-dimethylphenyl)-(4-nitro-7-piperidino-benzofurazan-5-yl)amine Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=C(C3=NON=C3C(=C2)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=C(C3=NON=C3C(=C2)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O3/c1-12-6-7-13(2)14(10-12)20-15-11-16(23-8-4-3-5-9-23)17-18(22-27-21-17)19(15)24(25)26/h6-7,10-11,20H,3-5,8-9H2,1-2H3