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

Systemtic Name: dodecyl 3-[(2-bromanyl-3-methoxy-3-oxidanylidene-propanoyl)amino]-4-chloranyl-benzoate Openeye Name: dodecyl 3-[(2-bromo-3-methoxy-3-oxo-propanoyl)amino]-4-chloro-benzoate CAS Name: 3-[(2-bromo-3-methoxy-1,3-dioxopropyl)amino]-4-chlorobenzoic acid dodecyl ester IUPAC Name: dodecyl 3-[(2-bromo-3-methoxy-3-oxopropanoyl)amino]-4-chlorobenzoate Traditional Name: 3-[(2-bromo-3-keto-3-methoxy-propanoyl)amino]-4-chloro-benzoic acid lauryl ester Formula: C23H33BrClNO5 MolecularWeight: 518.86882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33BrClNO5/c1-3-4-5-6-7-8-9-10-11-12-15-31-22(28)17-13-14-18(25)19(16-17)26-21(27)20(24)23(29)30-2/h13-14,16,20H,3-12,15H2,1-2H3,(H,26,27)