(diphenylmethyl) (E)-4-[5-chloranyl-1-(dimethylcarbamoyl)indol-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: (diphenylmethyl) (E)-4-[5-chloranyl-1-(dimethylcarbamoyl)indol-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: benzhydryl (E)-4-[5-chloro-1-(dimethylcarbamoyl)indol-3-yl]-4-hydroxy-2-oxo-but-3-enoate CAS Name: (E)-4-[5-chloro-1-[dimethylamino(oxo)methyl]-3-indolyl]-4-hydroxy-2-oxo-3-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (E)-4-[5-chloro-1-(dimethylcarbamoyl)indol-3-yl]-4-hydroxy-2-oxobut-3-enoate Traditional Name: (E)-4-[5-chloro-1-(dimethylcarbamoyl)indol-3-yl]-4-hydroxy-2-keto-but-3-enoic acid benzhydryl ester Formula: C28H23ClN2O5 MolecularWeight: 502.94562

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1C=C(C2=C1C=CC(=C2)Cl)C(=CC(=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CN(C)C(=O)N1C=C(C2=C1C=CC(=C2)Cl)/C(=C\C(=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)/O

InChI

InChI=1S/C28H23ClN2O5/c1-30(2)28(35)31-17-22(21-15-20(29)13-14-23(21)31)24(32)16-25(33)27(34)36-26(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-17,26,32H,1-2H3/b24-16+