N-(2,4-dimethylphenyl)-7-[(3R)-3-methylpiperidin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-amine

Systemtic Name: N-(2,4-dimethylphenyl)-7-[(3R)-3-methylpiperidin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-amine Openeye Name: N-(2,4-dimethylphenyl)-7-[(3R)-3-methyl-1-piperidyl]-4-nitro-2,1,3-benzoxadiazol-5-amine CAS Name: N-(2,4-dimethylphenyl)-7-[(3R)-3-methyl-1-piperidinyl]-4-nitro-2,1,3-benzoxadiazol-5-amine IUPAC Name: N-(2,4-dimethylphenyl)-7-[(3R)-3-methylpiperidin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-amine Traditional Name: (2,4-dimethylphenyl)-[7-[(3R)-3-methylpiperidino]-4-nitro-benzofurazan-5-yl]amine Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=C(C=C(C=C4)C)C

Isomeric SMILES

C[C@@H]1CCCN(C1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=C(C=C(C=C4)C)C

InChI

InChI=1S/C20H23N5O3/c1-12-6-7-15(14(3)9-12)21-16-10-17(24-8-4-5-13(2)11-24)18-19(23-28-22-18)20(16)25(26)27/h6-7,9-10,13,21H,4-5,8,11H2,1-3H3/t13-/m1/s1