methyl 4-chloranyl-3-[[3-(4-dodecoxyphenyl)-3-oxidanylidene-propanoyl]amino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[[3-(4-dodecoxyphenyl)-3-oxidanylidene-propanoyl]amino]benzoate Openeye Name: methyl 4-chloro-3-[[3-(4-dodecoxyphenyl)-3-oxo-propanoyl]amino]benzoate CAS Name: 4-chloro-3-[[3-(4-dodecoxyphenyl)-1,3-dioxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[3-(4-dodecoxyphenyl)-3-oxopropanoyl]amino]benzoate Traditional Name: 4-chloro-3-[[3-keto-3-(4-lauryloxyphenyl)propanoyl]amino]benzoic acid methyl ester Formula: C29H38ClNO5 MolecularWeight: 516.06872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl

InChI

InChI=1S/C29H38ClNO5/c1-3-4-5-6-7-8-9-10-11-12-19-36-24-16-13-22(14-17-24)27(32)21-28(33)31-26-20-23(29(34)35-2)15-18-25(26)30/h13-18,20H,3-12,19,21H2,1-2H3,(H,31,33)