ethyl 4-[[4-(4-ethoxycarbonylphenyl)imino-1-methyl-1,2-diazet-3-yl]amino]benzoate

Systemtic Name: ethyl 4-[[4-(4-ethoxycarbonylphenyl)imino-1-methyl-1,2-diazet-3-yl]amino]benzoate Openeye Name: ethyl 4-[[4-(4-ethoxycarbonylphenyl)imino-1-methyl-diazet-3-yl]amino]benzoate CAS Name: 4-[[4-(4-ethoxycarbonylphenyl)imino-1-methyl-3-diazetyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-ethoxycarbonylphenyl)imino-1-methyldiazet-3-yl]amino]benzoate Traditional Name: 4-[[4-(4-carbethoxyphenyl)imino-1-methyl-diazet-3-yl]amino]benzoic acid ethyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NN(C2=NC3=CC=C(C=C3)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NN(C2=NC3=CC=C(C=C3)C(=O)OCC)C

InChI

InChI=1S/C21H22N4O4/c1-4-28-20(26)14-6-10-16(11-7-14)22-18-19(25(3)24-18)23-17-12-8-15(9-13-17)21(27)29-5-2/h6-13H,4-5H2,1-3H3,(H,22,24)