5-azanyl-2-tert-butyl-7-(4-chloranyl-3-nitro-phenyl)-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile

Systemtic Name: 5-azanyl-2-tert-butyl-7-(4-chloranyl-3-nitro-phenyl)-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile Openeye Name: 5-amino-2-tert-butyl-7-(4-chloro-3-nitro-phenyl)-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile CAS Name: 5-amino-2-tert-butyl-7-(4-chloro-3-nitrophenyl)-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile IUPAC Name: 5-amino-2-tert-butyl-7-(4-chloro-3-nitrophenyl)-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile Traditional Name: 5-amino-2-tert-butyl-7-(4-chloro-3-nitro-phenyl)-1,7-dihydropyran[2,3-d]imidazole-6-carbonitrile Formula: C17H16ClN5O3 MolecularWeight: 373.79364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1)C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1)C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN5O3/c1-17(2,3)16-21-13-12(9(7-19)14(20)26-15(13)22-16)8-4-5-10(18)11(6-8)23(24)25/h4-6,12H,20H2,1-3H3,(H,21,22)