ethyl 4-[[2-[(5-chloranyl-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(5-chloranyl-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-[(5-chloro-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 4-[[2-[(5-chloro-2-ethoxyphenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(5-chloro-2-ethoxyphenyl)sulfonylamino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[[2-[(5-chloro-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoic acid ethyl ester Formula: C26H27ClN2O6S MolecularWeight: 531.02038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C26H27ClN2O6S/c1-3-34-23-15-12-20(27)17-24(23)36(32,33)29-22(16-18-8-6-5-7-9-18)25(30)28-21-13-10-19(11-14-21)26(31)35-4-2/h5-15,17,22,29H,3-4,16H2,1-2H3,(H,28,30)