(5-chloranylbenzotriazol-1-yl)-(3-methyl-4-nitro-phenyl)methanone

Systemtic Name: (5-chloranylbenzotriazol-1-yl)-(3-methyl-4-nitro-phenyl)methanone Openeye Name: (5-chlorobenzotriazol-1-yl)-(3-methyl-4-nitro-phenyl)methanone CAS Name: (5-chloro-1-benzotriazolyl)-(3-methyl-4-nitrophenyl)methanone IUPAC Name: (5-chlorobenzotriazol-1-yl)-(3-methyl-4-nitrophenyl)methanone Traditional Name: (5-chlorobenzotriazol-1-yl)-(3-methyl-4-nitro-phenyl)methanone Formula: C14H9ClN4O3 MolecularWeight: 316.69926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2C3=C(C=C(C=C3)Cl)N=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2C3=C(C=C(C=C3)Cl)N=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClN4O3/c1-8-6-9(2-4-12(8)19(21)22)14(20)18-13-5-3-10(15)7-11(13)16-17-18/h2-7H,1H3