[4-(2-methylbutyl)phenyl] 4-propylbenzoate

Systemtic Name: [4-(2-methylbutyl)phenyl] 4-propylbenzoate Openeye Name: [4-(2-methylbutyl)phenyl] 4-propylbenzoate CAS Name: 4-propylbenzoic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 4-propylbenzoate Traditional Name: 4-propylbenzoic acid [4-(2-methylbutyl)phenyl] ester Formula: C21H26O2 MolecularWeight: 310.42994

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

InChI

InChI=1S/C21H26O2/c1-4-6-17-7-11-19(12-8-17)21(22)23-20-13-9-18(10-14-20)15-16(3)5-2/h7-14,16H,4-6,15H2,1-3H3