2-(2-adamantyloxycarbonylamino)-3-(2H-indazol-3-yl)-2-methyl-propanoic acid

Systemtic Name: 2-(2-adamantyloxycarbonylamino)-3-(2H-indazol-3-yl)-2-methyl-propanoic acid Openeye Name: 2-(2-adamantyloxycarbonylamino)-3-(2H-indazol-3-yl)-2-methyl-propanoic acid CAS Name: 2-[[2-adamantyloxy(oxo)methyl]amino]-3-(2H-indazol-3-yl)-2-methylpropanoic acid IUPAC Name: 2-(2-adamantyloxycarbonylamino)-3-(2H-indazol-3-yl)-2-methylpropanoic acid Traditional Name: 2-(2-adamantyloxycarbonylamino)-3-(2H-indazol-3-yl)-2-methyl-propionic acid Formula: C22H27N3O4 MolecularWeight: 397.46748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C2C=CC=CC2=NN1)(C(=O)O)NC(=O)OC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC(CC1=C2C=CC=CC2=NN1)(C(=O)O)NC(=O)OC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H27N3O4/c1-22(20(26)27,11-18-16-4-2-3-5-17(16)24-25-18)23-21(28)29-19-14-7-12-6-13(9-14)10-15(19)8-12/h2-5,12-15,19H,6-11H2,1H3,(H,23,28)(H,24,25)(H,26,27)