tert-butyl (E)-3-[4-[5-methoxy-1-(phenylsulfonyl)indol-2-yl]carbonylphenyl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[4-[5-methoxy-1-(phenylsulfonyl)indol-2-yl]carbonylphenyl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[4-[1-(benzenesulfonyl)-5-methoxy-indole-2-carbonyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[1-(benzenesulfonyl)-5-methoxy-2-indolyl]-oxomethyl]phenyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[4-[1-(benzenesulfonyl)-5-methoxyindole-2-carbonyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(1-besyl-5-methoxy-indole-2-carbonyl)phenyl]acrylic acid tert-butyl ester Formula: C29H27NO6S MolecularWeight: 517.59278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC=C(C=C1)C(=O)C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)C=CC(=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC=C(C=C1)C(=O)C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)C=CC(=C3)OC

InChI

InChI=1S/C29H27NO6S/c1-29(2,3)36-27(31)17-12-20-10-13-21(14-11-20)28(32)26-19-22-18-23(35-4)15-16-25(22)30(26)37(33,34)24-8-6-5-7-9-24/h5-19H,1-4H3/b17-12+