(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-phenethylbenzoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-phenethylbenzoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C27H24O4 MolecularWeight: 412.47706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3CCC4=CC=CC=C4)C

InChI

InChI=1S/C27H24O4/c1-18-12-15-23-22(16-25(28)31-26(23)19(18)2)17-30-27(29)24-11-7-6-10-21(24)14-13-20-8-4-3-5-9-20/h3-12,15-16H,13-14,17H2,1-2H3