1-heptyl-4-phenyl-benzene ethanoate

Systemtic Name: 1-heptyl-4-phenyl-benzene ethanoate Openeye Name: 1-heptyl-4-phenyl-benzene acetate CAS Name: 1-heptyl-4-phenylbenzene acetate IUPAC Name: 1-heptyl-4-phenylbenzene acetate Traditional Name: 1-heptyl-4-phenyl-benzene acetate Formula: C21H27O2- MolecularWeight: 311.43788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2.CC(=O)[O-]

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2.CC(=O)[O-]

InChI

InChI=1S/C19H24.C2H4O2/c1-2-3-4-5-7-10-17-13-15-19(16-14-17)18-11-8-6-9-12-18;1-2(3)4/h6,8-9,11-16H,2-5,7,10H2,1H3;1H3,(H,3,4)/p-1