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

Systemtic Name: dodecyl 4-[(2-bromanyl-2-methyl-3-oxidanylidene-3-phenyl-propanoyl)amino]-3-chloranyl-benzoate Openeye Name: dodecyl 4-[(2-bromo-2-methyl-3-oxo-3-phenyl-propanoyl)amino]-3-chloro-benzoate CAS Name: 4-[(2-bromo-2-methyl-1,3-dioxo-3-phenylpropyl)amino]-3-chlorobenzoic acid dodecyl ester IUPAC Name: dodecyl 4-[(2-bromo-2-methyl-3-oxo-3-phenylpropanoyl)amino]-3-chlorobenzoate Traditional Name: 4-[(2-bromo-3-keto-2-methyl-3-phenyl-propanoyl)amino]-3-chloro-benzoic acid lauryl ester Formula: C29H37BrClNO4 MolecularWeight: 578.96538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37BrClNO4/c1-3-4-5-6-7-8-9-10-11-15-20-36-27(34)23-18-19-25(24(31)21-23)32-28(35)29(2,30)26(33)22-16-13-12-14-17-22/h12-14,16-19,21H,3-11,15,20H2,1-2H3,(H,32,35)