2-(3-pentadecylphenoxy)ethyl N-[4-[[5-oxidanylidene-1-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-3-yl]amino]phenyl]carbamate

Systemtic Name: 2-(3-pentadecylphenoxy)ethyl N-[4-[[5-oxidanylidene-1-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-3-yl]amino]phenyl]carbamate Openeye Name: 2-(3-pentadecylphenoxy)ethyl N-[4-[[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]amino]phenyl]carbamate CAS Name: N-[4-[[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]amino]phenyl]carbamic acid 2-(3-pentadecylphenoxy)ethyl ester IUPAC Name: 2-(3-pentadecylphenoxy)ethyl N-[4-[[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]amino]phenyl]carbamate Traditional Name: N-[4-[[5-keto-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]amino]phenyl]carbamic acid 2-(3-pentadecylphenoxy)ethyl ester Formula: C39H49Cl3N4O4 MolecularWeight: 744.18976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OCCOC(=O)NC2=CC=C(C=C2)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OCCOC(=O)NC2=CC=C(C=C2)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl

InChI

InChI=1S/C39H49Cl3N4O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-29-17-15-18-33(25-29)49-23-24-50-39(48)44-32-21-19-31(20-22-32)43-36-28-37(47)46(45-36)38-34(41)26-30(40)27-35(38)42/h15,17-22,25-27H,2-14,16,23-24,28H2,1H3,(H,43,45)(H,44,48)