4,8-dimethyl-7-phenacyloxy-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4,8-dimethyl-7-phenacyloxy-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-4,8-dimethyl-7-phenacyloxy-chromen-2-one CAS Name: 4,8-dimethyl-7-phenacyloxy-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-4,8-dimethyl-7-phenacyloxychromen-2-one Traditional Name: 3-benzyl-4,8-dimethyl-7-phenacyloxy-coumarin Formula: C26H22O4 MolecularWeight: 398.45048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H22O4/c1-17-21-13-14-24(29-16-23(27)20-11-7-4-8-12-20)18(2)25(21)30-26(28)22(17)15-19-9-5-3-6-10-19/h3-14H,15-16H2,1-2H3