(diphenylmethyl) (Z)-4-(5-chloranyl-1H-indol-3-yl)-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: (diphenylmethyl) (Z)-4-(5-chloranyl-1H-indol-3-yl)-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: benzhydryl (Z)-4-(5-chloro-1H-indol-3-yl)-4-hydroxy-2-oxo-but-3-enoate CAS Name: (Z)-4-(5-chloro-1H-indol-3-yl)-4-hydroxy-2-oxo-3-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (Z)-4-(5-chloro-1H-indol-3-yl)-4-hydroxy-2-oxobut-3-enoate Traditional Name: (Z)-4-(5-chloro-1H-indol-3-yl)-4-hydroxy-2-keto-but-3-enoic acid benzhydryl ester Formula: C25H18ClNO4 MolecularWeight: 431.86772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C(=O)C=C(C3=CNC4=C3C=C(C=C4)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C(=O)/C=C(/C3=CNC4=C3C=C(C=C4)Cl)\O

InChI

InChI=1S/C25H18ClNO4/c26-18-11-12-21-19(13-18)20(15-27-21)22(28)14-23(29)25(30)31-24(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-15,24,27-28H/b22-14-