4-[2-(phenylmethyl)phenyl]carbonylheptane-3,5-dione

Systemtic Name: 4-[2-(phenylmethyl)phenyl]carbonylheptane-3,5-dione Openeye Name: 4-(2-benzylbenzoyl)heptane-3,5-dione CAS Name: 4-[oxo-[2-(phenylmethyl)phenyl]methyl]heptane-3,5-dione IUPAC Name: 4-(2-benzylbenzoyl)heptane-3,5-dione Traditional Name: 4-(2-benzylbenzoyl)heptane-3,5-dione Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C(=O)CC)C(=O)C1=CC=CC=C1CC2=CC=CC=C2

Isomeric SMILES

CCC(=O)C(C(=O)CC)C(=O)C1=CC=CC=C1CC2=CC=CC=C2

InChI

InChI=1S/C21H22O3/c1-3-18(22)20(19(23)4-2)21(24)17-13-9-8-12-16(17)14-15-10-6-5-7-11-15/h5-13,20H,3-4,14H2,1-2H3