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

Systemtic Name: tert-butyl 4-(ethoxycarbonylamino)-5-methyl-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate Openeye Name: tert-butyl 4-(ethoxycarbonylamino)-5-methyl-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate CAS Name: 4-(ethoxycarbonylamino)-5-methyl-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(ethoxycarbonylamino)-5-methyl-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylate Traditional Name: 4-(carbethoxyamino)-5-methyl-1,3,3a,4,5,7a-hexahydroisoindole-2-carboxylic acid tert-butyl ester Formula: C17H28N2O4 MolecularWeight: 324.41522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1C(C=CC2C1CN(C2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)NC1C(C=CC2C1CN(C2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C17H28N2O4/c1-6-22-15(20)18-14-11(2)7-8-12-9-19(10-13(12)14)16(21)23-17(3,4)5/h7-8,11-14H,6,9-10H2,1-5H3,(H,18,20)