[4-(1-ethoxyethyl)phenyl] 4-butylbenzoate

Systemtic Name: [4-(1-ethoxyethyl)phenyl] 4-butylbenzoate Openeye Name: [4-(1-ethoxyethyl)phenyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [4-(1-ethoxyethyl)phenyl] ester IUPAC Name: [4-(1-ethoxyethyl)phenyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [4-(1-ethoxyethyl)phenyl] ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C)OCC

InChI

InChI=1S/C21H26O3/c1-4-6-7-17-8-10-19(11-9-17)21(22)24-20-14-12-18(13-15-20)16(3)23-5-2/h8-16H,4-7H2,1-3H3