[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] cyclohexanecarboxylate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] cyclohexanecarboxylate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C25H26O4 MolecularWeight: 390.47154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C4CCCCC4

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C4CCCCC4

InChI

InChI=1S/C25H26O4/c1-16-13-21(28-24(26)19-11-7-4-8-12-19)23-17(2)20(25(27)29-22(23)14-16)15-18-9-5-3-6-10-18/h3,5-6,9-10,13-14,19H,4,7-8,11-12,15H2,1-2H3