(2-chlorophenyl)sulfanyl 4-heptoxybenzoate

Systemtic Name: (2-chlorophenyl)sulfanyl 4-heptoxybenzoate Openeye Name: (2-chlorophenyl)sulfanyl 4-heptoxybenzoate CAS Name: 4-heptoxybenzoic acid [(2-chlorophenyl)thio] ester IUPAC Name: (2-chlorophenyl)sulfanyl 4-heptoxybenzoate Traditional Name: 4-heptoxybenzoic acid [(2-chlorophenyl)thio] ester Formula: C20H23ClO3S MolecularWeight: 378.91282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2Cl

InChI

InChI=1S/C20H23ClO3S/c1-2-3-4-5-8-15-23-17-13-11-16(12-14-17)20(22)24-25-19-10-7-6-9-18(19)21/h6-7,9-14H,2-5,8,15H2,1H3