ethyl 3-[(3-chloranyl-4-ethoxy-phenyl)carbonylamino]-4-(4-ethanoylpiperazin-1-yl)benzoate

Systemtic Name: ethyl 3-[(3-chloranyl-4-ethoxy-phenyl)carbonylamino]-4-(4-ethanoylpiperazin-1-yl)benzoate Openeye Name: ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-chloro-4-ethoxy-benzoyl)amino]benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-[[(3-chloro-4-ethoxyphenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-chloro-4-ethoxybenzoyl)amino]benzoate Traditional Name: 4-(4-acetylpiperazino)-3-[(3-chloro-4-ethoxy-benzoyl)amino]benzoic acid ethyl ester Formula: C24H28ClN3O5 MolecularWeight: 473.94922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCN(CC3)C(=O)C)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCN(CC3)C(=O)C)Cl

InChI

InChI=1S/C24H28ClN3O5/c1-4-32-22-9-7-17(14-19(22)25)23(30)26-20-15-18(24(31)33-5-2)6-8-21(20)28-12-10-27(11-13-28)16(3)29/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,26,30)