N-[(3aS)-2-(3-chloranyl-4-methyl-phenyl)-3,3a-dihydrobenzotriazol-5-yl]-2-(4-ethylphenoxy)ethanamide

Systemtic Name: N-[(3aS)-2-(3-chloranyl-4-methyl-phenyl)-3,3a-dihydrobenzotriazol-5-yl]-2-(4-ethylphenoxy)ethanamide Openeye Name: N-[(3aS)-2-(3-chloro-4-methyl-phenyl)-3,3a-dihydrobenzotriazol-5-yl]-2-(4-ethylphenoxy)acetamide CAS Name: N-[(3aS)-2-(3-chloro-4-methylphenyl)-3,3a-dihydrobenzotriazol-5-yl]-2-(4-ethylphenoxy)acetamide IUPAC Name: N-[(3aS)-2-(3-chloro-4-methylphenyl)-3,3a-dihydrobenzotriazol-5-yl]-2-(4-ethylphenoxy)acetamide Traditional Name: N-[(3aS)-2-(3-chloro-4-methyl-phenyl)-3,3a-dihydrobenzotriazol-5-yl]-2-(4-ethylphenoxy)acetamide Formula: C23H23ClN4O2 MolecularWeight: 422.90732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC2=CC3C(=NN(N3)C4=CC(=C(C=C4)C)Cl)C=C2

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC2=C[C@H]3C(=NN(N3)C4=CC(=C(C=C4)C)Cl)C=C2

InChI

InChI=1S/C23H23ClN4O2/c1-3-16-5-9-19(10-6-16)30-14-23(29)25-17-7-11-21-22(12-17)27-28(26-21)18-8-4-15(2)20(24)13-18/h4-13,22,27H,3,14H2,1-2H3,(H,25,29)/t22-/m0/s1