(phenylmethyl) (2E)-3-(2-bromophenyl)-3-oxidanylidene-2-(5-phenyl-1H-pyridin-2-ylidene)propanoate

Systemtic Name: (phenylmethyl) (2E)-3-(2-bromophenyl)-3-oxidanylidene-2-(5-phenyl-1H-pyridin-2-ylidene)propanoate Openeye Name: benzyl (2E)-3-(2-bromophenyl)-3-oxo-2-(5-phenyl-1H-pyridin-2-ylidene)propanoate CAS Name: (2E)-3-(2-bromophenyl)-3-oxo-2-(5-phenyl-1H-pyridin-2-ylidene)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2E)-3-(2-bromophenyl)-3-oxo-2-(5-phenyl-1H-pyridin-2-ylidene)propanoate Traditional Name: (2E)-3-(2-bromophenyl)-3-keto-2-(5-phenyl-1H-pyridin-2-ylidene)propionic acid benzyl ester Formula: C27H20BrNO3 MolecularWeight: 486.3566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=C2C=CC(=CN2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/C(=C/2\C=CC(=CN2)C3=CC=CC=C3)/C(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C27H20BrNO3/c28-23-14-8-7-13-22(23)26(30)25(27(31)32-18-19-9-3-1-4-10-19)24-16-15-21(17-29-24)20-11-5-2-6-12-20/h1-17,29H,18H2/b25-24+