8-methyl-4-phenyl-3-(2-phenylethynyl)-7-phenylmethoxy-chromen-2-one

Systemtic Name: 8-methyl-4-phenyl-3-(2-phenylethynyl)-7-phenylmethoxy-chromen-2-one Openeye Name: 7-benzyloxy-8-methyl-4-phenyl-3-(2-phenylethynyl)chromen-2-one CAS Name: 8-methyl-4-phenyl-3-(2-phenylethynyl)-7-phenylmethoxy-1-benzopyran-2-one IUPAC Name: 8-methyl-4-phenyl-3-(2-phenylethynyl)-7-phenylmethoxychromen-2-one Traditional Name: 7-benzoxy-8-methyl-4-phenyl-3-(2-phenylethynyl)coumarin Formula: C31H22O3 MolecularWeight: 442.50458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C(=C2C3=CC=CC=C3)C#CC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C(=C2C3=CC=CC=C3)C#CC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H22O3/c1-22-28(33-21-24-13-7-3-8-14-24)20-19-26-29(25-15-9-4-10-16-25)27(31(32)34-30(22)26)18-17-23-11-5-2-6-12-23/h2-16,19-20H,21H2,1H3