ethyl 4-[[N-(4-ethoxycarbonylphenyl)-C-phenyl-carbonimidoyl]amino]benzoate hydrochloride

Systemtic Name: ethyl 4-[[N-(4-ethoxycarbonylphenyl)-C-phenyl-carbonimidoyl]amino]benzoate hydrochloride Openeye Name: ethyl 4-[[N-(4-ethoxycarbonylphenyl)-C-phenyl-carbonimidoyl]amino]benzoate hydrochloride CAS Name: 4-[[(4-ethoxycarbonylphenyl)imino-phenylmethyl]amino]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[[N-(4-ethoxycarbonylphenyl)-C-phenylcarbonimidoyl]amino]benzoate hydrochloride Traditional Name: 4-[[N-(4-carbethoxyphenyl)-C-phenyl-carbonimidoyl]amino]benzoic acid ethyl ester hydrochloride Formula: C25H25ClN2O4 MolecularWeight: 452.93

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C(=O)OCC)C3=CC=CC=C3.Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C(=O)OCC)C3=CC=CC=C3.Cl

InChI

InChI=1S/C25H24N2O4.ClH/c1-3-30-24(28)19-10-14-21(15-11-19)26-23(18-8-6-5-7-9-18)27-22-16-12-20(13-17-22)25(29)31-4-2;/h5-17H,3-4H2,1-2H3,(H,26,27);1H