[3-butyl-4-(phenylcarbonyloxy)hept-6-en-2-yl] benzoate

Systemtic Name: [3-butyl-4-(phenylcarbonyloxy)hept-6-en-2-yl] benzoate Openeye Name: (3-benzoyloxy-2-butyl-1-methyl-hex-5-enyl) benzoate CAS Name: benzoic acid (4-benzoyloxy-3-butylhept-6-en-2-yl) ester IUPAC Name: (4-benzoyloxy-3-butylhept-6-en-2-yl) benzoate Traditional Name: benzoic acid (3-benzoyloxy-2-butyl-1-methyl-hex-5-enyl) ester Formula: C25H30O4 MolecularWeight: 394.5033

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)OC(=O)C1=CC=CC=C1)C(CC=C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(C(C)OC(=O)C1=CC=CC=C1)C(CC=C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C25H30O4/c1-4-6-18-22(19(3)28-24(26)20-14-9-7-10-15-20)23(13-5-2)29-25(27)21-16-11-8-12-17-21/h5,7-12,14-17,19,22-23H,2,4,6,13,18H2,1,3H3