ethyl 3-chloranyl-5-[(3-dodecoxycarbonylphenyl)methyl]-2-oxidanyl-benzoate

Systemtic Name: ethyl 3-chloranyl-5-[(3-dodecoxycarbonylphenyl)methyl]-2-oxidanyl-benzoate Openeye Name: ethyl 3-chloro-5-[(3-dodecoxycarbonylphenyl)methyl]-2-hydroxy-benzoate CAS Name: 3-chloro-5-[[3-[dodecoxy(oxo)methyl]phenyl]methyl]-2-hydroxybenzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-5-[(3-dodecoxycarbonylphenyl)methyl]-2-hydroxybenzoate Traditional Name: 3-chloro-2-hydroxy-5-(3-lauryloxycarbonylbenzyl)benzoic acid ethyl ester Formula: C29H39ClO5 MolecularWeight: 503.06996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)CC2=CC(=C(C(=C2)C(=O)OCC)O)Cl

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)CC2=CC(=C(C(=C2)C(=O)OCC)O)Cl

InChI

InChI=1S/C29H39ClO5/c1-3-5-6-7-8-9-10-11-12-13-17-35-28(32)24-16-14-15-22(19-24)18-23-20-25(29(33)34-4-2)27(31)26(30)21-23/h14-16,19-21,31H,3-13,17-18H2,1-2H3