2-(4-chlorophenyl)-2-[3-[(5-methoxyindazol-1-yl)methylamino]phenyl]peroxy-ethanoic acid

Systemtic Name: 2-(4-chlorophenyl)-2-[3-[(5-methoxyindazol-1-yl)methylamino]phenyl]peroxy-ethanoic acid Openeye Name: 2-(4-chlorophenyl)-2-[3-[(5-methoxyindazol-1-yl)methylamino]phenyl]peroxy-acetic acid CAS Name: 2-(4-chlorophenyl)-2-[3-[(5-methoxy-1-indazolyl)methylamino]phenyl]dioxyacetic acid IUPAC Name: 2-(4-chlorophenyl)-2-[3-[(5-methoxyindazol-1-yl)methylamino]phenyl]peroxyacetic acid Traditional Name: 2-(4-chlorophenyl)-2-[3-[(5-methoxyindazol-1-yl)methylamino]phenyl]peroxy-acetic acid Formula: C23H20ClN3O5 MolecularWeight: 453.875

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(N=C2)CNC3=CC(=CC=C3)OOC(C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N(N=C2)CNC3=CC(=CC=C3)OOC(C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C23H20ClN3O5/c1-30-19-9-10-21-16(11-19)13-26-27(21)14-25-18-3-2-4-20(12-18)31-32-22(23(28)29)15-5-7-17(24)8-6-15/h2-13,22,25H,14H2,1H3,(H,28,29)