methyl 4-[[3,5-bis(chloranyl)-4-heptoxy-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[3,5-bis(chloranyl)-4-heptoxy-phenyl]carbonylamino]benzoate Openeye Name: methyl 4-[(3,5-dichloro-4-heptoxy-benzoyl)amino]benzoate CAS Name: 4-[[(3,5-dichloro-4-heptoxyphenyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3,5-dichloro-4-heptoxybenzoyl)amino]benzoate Traditional Name: 4-[(3,5-dichloro-4-heptoxy-benzoyl)amino]benzoic acid methyl ester Formula: C22H25Cl2NO4 MolecularWeight: 438.3442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C22H25Cl2NO4/c1-3-4-5-6-7-12-29-20-18(23)13-16(14-19(20)24)21(26)25-17-10-8-15(9-11-17)22(27)28-2/h8-11,13-14H,3-7,12H2,1-2H3,(H,25,26)