ethyl 4-[2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-phenethyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-phenethyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(3-chloro-4-methoxy-phenyl)sulfonyl-phenethyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(3-chloro-4-methoxyphenyl)sulfonyl-phenethylamino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(3-chloro-4-methoxyphenyl)sulfonyl-phenethylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3-chloro-4-methoxy-phenyl)sulfonyl-phenethyl-amino]acetyl]amino]benzoic acid ethyl ester Formula: C26H27ClN2O6S MolecularWeight: 531.02038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C26H27ClN2O6S/c1-3-35-26(31)20-9-11-21(12-10-20)28-25(30)18-29(16-15-19-7-5-4-6-8-19)36(32,33)22-13-14-24(34-2)23(27)17-22/h4-14,17H,3,15-16,18H2,1-2H3,(H,28,30)