[4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]methylazanium

Systemtic Name: [4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]methylazanium Openeye Name: [4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]methylammonium CAS Name: [4-(4-methyl-3-nitrophenyl)-2-thiazolyl]methylammonium IUPAC Name: [4-(4-methyl-3-nitrophenyl)-1,3-thiazol-2-yl]methylazanium Traditional Name: [4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]methylammonium Formula: C11H12N3O2S+ MolecularWeight: 250.29688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)C[NH3+])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)C[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O2S/c1-7-2-3-8(4-10(7)14(15)16)9-6-17-11(5-12)13-9/h2-4,6H,5,12H2,1H3/p+1