(2-propan-2-ylphenyl) 4-pentoxybenzoate

Systemtic Name: (2-propan-2-ylphenyl) 4-pentoxybenzoate Openeye Name: (2-isopropylphenyl) 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid o-cumenyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(C)C

InChI

InChI=1S/C21H26O3/c1-4-5-8-15-23-18-13-11-17(12-14-18)21(22)24-20-10-7-6-9-19(20)16(2)3/h6-7,9-14,16H,4-5,8,15H2,1-3H3