tert-butyl (E)-3-[2-(phenylcarbonyl)-1-(phenylsulfonyl)indol-5-yl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[2-(phenylcarbonyl)-1-(phenylsulfonyl)indol-5-yl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[1-(benzenesulfonyl)-2-benzoyl-indol-5-yl]prop-2-enoate CAS Name: (E)-3-[1-(benzenesulfonyl)-2-benzoyl-5-indolyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[1-(benzenesulfonyl)-2-benzoylindol-5-yl]prop-2-enoate Traditional Name: (E)-3-(2-benzoyl-1-besyl-indol-5-yl)acrylic acid tert-butyl ester Formula: C28H25NO5S MolecularWeight: 487.5668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC2=C(C=C1)N(C(=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC2=C(C=C1)N(C(=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H25NO5S/c1-28(2,3)34-26(30)17-15-20-14-16-24-22(18-20)19-25(27(31)21-10-6-4-7-11-21)29(24)35(32,33)23-12-8-5-9-13-23/h4-19H,1-3H3/b17-15+