tert-butyl (3aR,9bS)-2-(2-oxidanylpropan-2-yl)-3a,9b-dihydrobenzo[g]indole-1-carboxylate

Systemtic Name: tert-butyl (3aR,9bS)-2-(2-oxidanylpropan-2-yl)-3a,9b-dihydrobenzo[g]indole-1-carboxylate Openeye Name: tert-butyl (3aR,9bS)-2-(1-hydroxy-1-methyl-ethyl)-3a,9b-dihydrobenzo[g]indole-1-carboxylate CAS Name: (3aR,9bS)-2-(2-hydroxypropan-2-yl)-3a,9b-dihydrobenzo[g]indole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3aR,9bS)-2-(2-hydroxypropan-2-yl)-3a,9b-dihydrobenzo[g]indole-1-carboxylate Traditional Name: (3aR,9bS)-2-(1-hydroxy-1-methyl-ethyl)-3a,9b-dihydrobenz[g]indole-1-carboxylic acid tert-butyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2C(C=CC3=CC=CC=C23)C=C1C(C)(C)O

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H]2[C@H](C=CC3=CC=CC=C23)C=C1C(C)(C)O

InChI

InChI=1S/C20H25NO3/c1-19(2,3)24-18(22)21-16(20(4,5)23)12-14-11-10-13-8-6-7-9-15(13)17(14)21/h6-12,14,17,23H,1-5H3/t14-,17+/m1/s1