2-chloroethyl 3-butyl-4-phenyl-benzoate

Systemtic Name: 2-chloroethyl 3-butyl-4-phenyl-benzoate Openeye Name: 2-chloroethyl 3-butyl-4-phenyl-benzoate CAS Name: 3-butyl-4-phenylbenzoic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 3-butyl-4-phenylbenzoate Traditional Name: 3-butyl-4-phenyl-benzoic acid 2-chloroethyl ester Formula: C19H21ClO2 MolecularWeight: 316.82184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C(=O)OCCCl)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C(=O)OCCCl)C2=CC=CC=C2

InChI

InChI=1S/C19H21ClO2/c1-2-3-7-16-14-17(19(21)22-13-12-20)10-11-18(16)15-8-5-4-6-9-15/h4-6,8-11,14H,2-3,7,12-13H2,1H3