(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-phenyladamantane-1-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-phenyladamantane-1-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-phenyladamantane-1-carboxylate CAS Name: 3-phenyl-1-adamantanecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-phenyladamantane-1-carboxylate Traditional Name: 3-phenyladamantane-1-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C31H28O4 MolecularWeight: 464.55162

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5)C7=CC=CC=C7

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5)C7=CC=CC=C7

InChI

InChI=1S/C31H28O4/c32-27-13-23(28-25-9-5-4-6-22(25)10-11-26(28)35-27)18-34-29(33)31-16-20-12-21(17-31)15-30(14-20,19-31)24-7-2-1-3-8-24/h1-11,13,20-21H,12,14-19H2