N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N,2-dimethyl-3-nitro-benzamide

Systemtic Name: N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N,2-dimethyl-3-nitro-benzamide Openeye Name: N-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-N,2-dimethyl-3-nitro-benzamide CAS Name: N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N,2-dimethyl-3-nitrobenzamide IUPAC Name: N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N,2-dimethyl-3-nitrobenzamide Traditional Name: N-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-N,2-dimethyl-3-nitro-benzamide Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)OCC

InChI

InChI=1S/C21H25N3O6/c1-5-29-18-11-10-15(12-19(18)30-6-2)22-20(25)13-23(4)21(26)16-8-7-9-17(14(16)3)24(27)28/h7-12H,5-6,13H2,1-4H3,(H,22,25)