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

Systemtic Name: butyl 4-[[3,5-bis(chloranyl)-4-heptoxy-phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[(3,5-dichloro-4-heptoxy-benzoyl)amino]benzoate CAS Name: 4-[[(3,5-dichloro-4-heptoxyphenyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3,5-dichloro-4-heptoxybenzoyl)amino]benzoate Traditional Name: 4-[(3,5-dichloro-4-heptoxy-benzoyl)amino]benzoic acid butyl ester Formula: C25H31Cl2NO4 MolecularWeight: 480.42394

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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)OCCCC)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H31Cl2NO4/c1-3-5-7-8-9-15-31-23-21(26)16-19(17-22(23)27)24(29)28-20-12-10-18(11-13-20)25(30)32-14-6-4-2/h10-13,16-17H,3-9,14-15H2,1-2H3,(H,28,29)