4-[(2,4-dimethoxyphenyl)amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[(2,4-dimethoxyphenyl)amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-(2,4-dimethoxyanilino)-3-nitro-benzonitrile CAS Name: 4-(2,4-dimethoxyanilino)-3-nitrobenzonitrile IUPAC Name: 4-(2,4-dimethoxyanilino)-3-nitrobenzonitrile Traditional Name: 4-(2,4-dimethoxyanilino)-3-nitro-benzonitrile Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])OC

InChI

InChI=1S/C15H13N3O4/c1-21-11-4-6-13(15(8-11)22-2)17-12-5-3-10(9-16)7-14(12)18(19)20/h3-8,17H,1-2H3