tert-butyl (1S)-1-(hydroxymethyl)-5-(methoxymethoxy)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylate

Systemtic Name: tert-butyl (1S)-1-(hydroxymethyl)-5-(methoxymethoxy)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylate Openeye Name: tert-butyl (1S)-1-(hydroxymethyl)-5-(methoxymethoxy)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylate CAS Name: (1S)-1-(hydroxymethyl)-5-(methoxymethoxy)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S)-1-(hydroxymethyl)-5-(methoxymethoxy)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylate Traditional Name: (1S)-5-(methoxymethoxy)-4-methyl-1-methylol-1,2-dihydrobenz[e]indole-3-carboxylic acid tert-butyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C3=C1N(CC3CO)C(=O)OC(C)(C)C)OCOC

Isomeric SMILES

CC1=C(C2=CC=CC=C2C3=C1N(C[C@H]3CO)C(=O)OC(C)(C)C)OCOC

InChI

InChI=1S/C21H27NO5/c1-13-18-17(14(11-23)10-22(18)20(24)27-21(2,3)4)15-8-6-7-9-16(15)19(13)26-12-25-5/h6-9,14,23H,10-12H2,1-5H3/t14-/m0/s1