ethyl 1-[[(2-azanyl-6-chloranyl-7-ethyl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-[[(2-azanyl-6-chloranyl-7-ethyl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropane-1-carboxylate Openeye Name: ethyl 1-[[(2-amino-6-chloro-7-ethyl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropanecarboxylate CAS Name: 1-[[(2-amino-6-chloro-7-ethyl-1,3-benzothiazol-4-yl)oxy-phenoxyphosphoryl]amino]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[(2-amino-6-chloro-7-ethyl-1,3-benzothiazol-4-yl)oxy-phenoxyphosphoryl]amino]cyclopropane-1-carboxylate Traditional Name: 1-[[(2-amino-6-chloro-7-ethyl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropanecarboxylic acid ethyl ester Formula: C21H23ClN3O5PS MolecularWeight: 495.916181

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C2=C1SC(=N2)N)OP(=O)(NC3(CC3)C(=O)OCC)OC4=CC=CC=C4)Cl

Isomeric SMILES

CCC1=C(C=C(C2=C1SC(=N2)N)OP(=O)(NC3(CC3)C(=O)OCC)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C21H23ClN3O5PS/c1-3-14-15(22)12-16(17-18(14)32-20(23)24-17)30-31(27,29-13-8-6-5-7-9-13)25-21(10-11-21)19(26)28-4-2/h5-9,12H,3-4,10-11H2,1-2H3,(H2,23,24)(H,25,27)