dodecyl 3-[[2-bromanyl-3-[(2-chloranyl-5-dodecoxycarbonyl-phenyl)amino]-3-oxidanylidene-propanoyl]amino]-4-chloranyl-benzoate

Systemtic Name: dodecyl 3-[[2-bromanyl-3-[(2-chloranyl-5-dodecoxycarbonyl-phenyl)amino]-3-oxidanylidene-propanoyl]amino]-4-chloranyl-benzoate Openeye Name: dodecyl 3-[[2-bromo-3-(2-chloro-5-dodecoxycarbonyl-anilino)-3-oxo-propanoyl]amino]-4-chloro-benzoate CAS Name: 3-[[2-bromo-3-[2-chloro-5-[dodecoxy(oxo)methyl]anilino]-1,3-dioxopropyl]amino]-4-chlorobenzoic acid dodecyl ester IUPAC Name: dodecyl 3-[[2-bromo-3-(2-chloro-5-dodecoxycarbonylanilino)-3-oxopropanoyl]amino]-4-chlorobenzoate Traditional Name: 3-[[2-bromo-3-(2-chloro-5-lauryloxycarbonyl-anilino)-3-keto-propanoyl]amino]-4-chloro-benzoic acid lauryl ester Formula: C41H59BrCl2N2O6 MolecularWeight: 826.72696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)NC2=C(C=CC(=C2)C(=O)OCCCCCCCCCCCC)Cl)Br

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)NC2=C(C=CC(=C2)C(=O)OCCCCCCCCCCCC)Cl)Br

InChI

InChI=1S/C41H59BrCl2N2O6/c1-3-5-7-9-11-13-15-17-19-21-27-51-40(49)31-23-25-33(43)35(29-31)45-38(47)37(42)39(48)46-36-30-32(24-26-34(36)44)41(50)52-28-22-20-18-16-14-12-10-8-6-4-2/h23-26,29-30,37H,3-22,27-28H2,1-2H3,(H,45,47)(H,46,48)