tert-butyl 4-(ethoxycarbonylamino)-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate

Systemtic Name: tert-butyl 4-(ethoxycarbonylamino)-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate Openeye Name: tert-butyl 4-(ethoxycarbonylamino)-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate CAS Name: 4-(ethoxycarbonylamino)-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(ethoxycarbonylamino)-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate Traditional Name: 4-(carbethoxyamino)-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylic acid tert-butyl ester Formula: C16H26N2O4 MolecularWeight: 310.38864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1CC=CC2C1CN(C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)NC1CC=CC2C1CN(C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H26N2O4/c1-5-21-14(19)17-13-8-6-7-11-9-18(10-12(11)13)15(20)22-16(2,3)4/h6-7,11-13H,5,8-10H2,1-4H3,(H,17,19)