[(2,2-dimethylchromen-6-yl)-(3-hydroxyphenyl)methyl] 4-phenylbenzoate

Systemtic Name: [(2,2-dimethylchromen-6-yl)-(3-hydroxyphenyl)methyl] 4-phenylbenzoate Openeye Name: [(2,2-dimethylchromen-6-yl)-(3-hydroxyphenyl)methyl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [(2,2-dimethyl-1-benzopyran-6-yl)-(3-hydroxyphenyl)methyl] ester IUPAC Name: [(2,2-dimethylchromen-6-yl)-(3-hydroxyphenyl)methyl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [(2,2-dimethylchromen-6-yl)-(3-hydroxyphenyl)methyl] ester Formula: C31H26O4 MolecularWeight: 462.53574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=CC(=C2)C(C3=CC(=CC=C3)O)OC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1(C=CC2=C(O1)C=CC(=C2)C(C3=CC(=CC=C3)O)OC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C31H26O4/c1-31(2)18-17-24-19-26(15-16-28(24)35-31)29(25-9-6-10-27(32)20-25)34-30(33)23-13-11-22(12-14-23)21-7-4-3-5-8-21/h3-20,29,32H,1-2H3