2-ethylhexyl 4-[[(1R)-5-tert-butyl-2,3-dihydro-1H-inden-1-yl]carbamoylamino]indazole-1-carboxylate

Systemtic Name: 2-ethylhexyl 4-[[(1R)-5-tert-butyl-2,3-dihydro-1H-inden-1-yl]carbamoylamino]indazole-1-carboxylate Openeye Name: 2-ethylhexyl 4-[[(1R)-5-tert-butylindan-1-yl]carbamoylamino]indazole-1-carboxylate CAS Name: 4-[[[[(1R)-5-tert-butyl-2,3-dihydro-1H-inden-1-yl]amino]-oxomethyl]amino]-1-indazolecarboxylic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 4-[[(1R)-5-tert-butyl-2,3-dihydro-1H-inden-1-yl]carbamoylamino]indazole-1-carboxylate Traditional Name: 4-[[(1R)-5-tert-butylindan-1-yl]carbamoylamino]indazole-1-carboxylic acid 2-ethylhexyl ester Formula: C30H40N4O3 MolecularWeight: 504.6636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)N1C2=C(C=N1)C(=CC=C2)NC(=O)NC3CCC4=C3C=CC(=C4)C(C)(C)C

Isomeric SMILES

CCCCC(CC)COC(=O)N1C2=C(C=N1)C(=CC=C2)NC(=O)N[C@@H]3CCC4=C3C=CC(=C4)C(C)(C)C

InChI

InChI=1S/C30H40N4O3/c1-6-8-10-20(7-2)19-37-29(36)34-27-12-9-11-25(24(27)18-31-34)32-28(35)33-26-16-13-21-17-22(30(3,4)5)14-15-23(21)26/h9,11-12,14-15,17-18,20,26H,6-8,10,13,16,19H2,1-5H3,(H2,32,33,35)/t20?,26-/m1/s1