4-[(4,5-dimethoxy-2-methyl-phenyl)amino]-3-nitro-benzamide

Systemtic Name: 4-[(4,5-dimethoxy-2-methyl-phenyl)amino]-3-nitro-benzamide Openeye Name: 4-(4,5-dimethoxy-2-methyl-anilino)-3-nitro-benzamide CAS Name: 4-(4,5-dimethoxy-2-methylanilino)-3-nitrobenzamide IUPAC Name: 4-(4,5-dimethoxy-2-methylanilino)-3-nitrobenzamide Traditional Name: 4-(4,5-dimethoxy-2-methyl-anilino)-3-nitro-benzamide Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C16H17N3O5/c1-9-6-14(23-2)15(24-3)8-12(9)18-11-5-4-10(16(17)20)7-13(11)19(21)22/h4-8,18H,1-3H3,(H2,17,20)