1,7-bis(4-methylphenyl)-4-(4-methylphenyl)carbonyl-3,5-diphenyl-heptane-1,7-dione

Systemtic Name: 1,7-bis(4-methylphenyl)-4-(4-methylphenyl)carbonyl-3,5-diphenyl-heptane-1,7-dione Openeye Name: 4-(4-methylbenzoyl)-3,5-diphenyl-1,7-bis(p-tolyl)heptane-1,7-dione CAS Name: 1,7-bis(4-methylphenyl)-4-[(4-methylphenyl)-oxomethyl]-3,5-diphenylheptane-1,7-dione IUPAC Name: 4-(4-methylbenzoyl)-1,7-bis(4-methylphenyl)-3,5-diphenylheptane-1,7-dione Traditional Name: 3,5-diphenyl-4-p-toluoyl-1,7-bis(p-tolyl)heptane-1,7-dione Formula: C41H38O3 MolecularWeight: 578.73862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(C2=CC=CC=C2)C(C(CC(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC(C2=CC=CC=C2)C(C(CC(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C41H38O3/c1-28-14-20-33(21-15-28)38(42)26-36(31-10-6-4-7-11-31)40(41(44)35-24-18-30(3)19-25-35)37(32-12-8-5-9-13-32)27-39(43)34-22-16-29(2)17-23-34/h4-25,36-37,40H,26-27H2,1-3H3