methyl 4-[[6-(2-ethylhexanoylamino)indazol-1-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[6-(2-ethylhexanoylamino)indazol-1-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[6-(2-ethylhexanoylamino)indazol-1-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[6-[(2-ethyl-1-oxohexyl)amino]-1-indazolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[6-(2-ethylhexanoylamino)indazol-1-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[6-(2-ethylhexanoylamino)indazol-1-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC2=C(C=C1)C=NN2CC3=C(C=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC2=C(C=C1)C=NN2CC3=C(C=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C25H31N3O4/c1-5-7-8-17(6-2)24(29)27-21-12-11-19-15-26-28(22(19)14-21)16-20-10-9-18(25(30)32-4)13-23(20)31-3/h9-15,17H,5-8,16H2,1-4H3,(H,27,29)