ethyl 4-[2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(3-benzylsulfonylindol-1-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[3-(phenylmethyl)sulfonyl-1-indolyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-benzylsulfonylindol-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-benzylsulfonylindol-1-yl)acetyl]amino]benzoic acid ethyl ester Formula: C26H24N2O5S MolecularWeight: 476.54416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O5S/c1-2-33-26(30)20-12-14-21(15-13-20)27-25(29)17-28-16-24(22-10-6-7-11-23(22)28)34(31,32)18-19-8-4-3-5-9-19/h3-16H,2,17-18H2,1H3,(H,27,29)