ethyl 7-(butoxycarbonylamino)-2,2-dipropyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate

Systemtic Name: ethyl 7-(butoxycarbonylamino)-2,2-dipropyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate Openeye Name: ethyl 7-(butoxycarbonylamino)-2,2-dipropyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate CAS Name: 7-[[butoxy(oxo)methyl]amino]-2,2-dipropyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 7-(butoxycarbonylamino)-2,2-dipropyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-(butoxycarbonylamino)-2,2-dipropyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid ethyl ester Formula: C21H35NO6 MolecularWeight: 397.5057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1CC(=CC2C1OC(O2)(CCC)CCC)C(=O)OCC

Isomeric SMILES

CCCCOC(=O)NC1CC(=CC2C1OC(O2)(CCC)CCC)C(=O)OCC

InChI

InChI=1S/C21H35NO6/c1-5-9-12-26-20(24)22-16-13-15(19(23)25-8-4)14-17-18(16)28-21(27-17,10-6-2)11-7-3/h14,16-18H,5-13H2,1-4H3,(H,22,24)