N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-3-nitro-benzamide CAS Name: N-[4-(3-chloro-4-methoxyphenyl)-2-thiazolyl]-3-nitrobenzamide IUPAC Name: N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-3-nitro-benzamide Formula: C17H12ClN3O4S MolecularWeight: 389.81288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClN3O4S/c1-25-15-6-5-10(8-13(15)18)14-9-26-17(19-14)20-16(22)11-3-2-4-12(7-11)21(23)24/h2-9H,1H3,(H,19,20,22)