dodecyl 3-[[2-bromanyl-2-chloranyl-3-(4-methoxyphenyl)-3-oxidanylidene-propanoyl]amino]benzoate

Systemtic Name: dodecyl 3-[[2-bromanyl-2-chloranyl-3-(4-methoxyphenyl)-3-oxidanylidene-propanoyl]amino]benzoate Openeye Name: dodecyl 3-[[2-bromo-2-chloro-3-(4-methoxyphenyl)-3-oxo-propanoyl]amino]benzoate CAS Name: 3-[[2-bromo-2-chloro-3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]benzoic acid dodecyl ester IUPAC Name: dodecyl 3-[[2-bromo-2-chloro-3-(4-methoxyphenyl)-3-oxopropanoyl]amino]benzoate Traditional Name: 3-[[2-bromo-2-chloro-3-keto-3-(4-methoxyphenyl)propanoyl]amino]benzoic acid lauryl ester Formula: C29H37BrClNO5 MolecularWeight: 594.96478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(C(=O)C2=CC=C(C=C2)OC)(Cl)Br

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(C(=O)C2=CC=C(C=C2)OC)(Cl)Br

InChI

InChI=1S/C29H37BrClNO5/c1-3-4-5-6-7-8-9-10-11-12-20-37-27(34)23-14-13-15-24(21-23)32-28(35)29(30,31)26(33)22-16-18-25(36-2)19-17-22/h13-19,21H,3-12,20H2,1-2H3,(H,32,35)