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

Systemtic Name: tert-butyl (1S)-1-(methoxymethyl)-4-methyl-5-oxidanyl-1,2-dihydrobenzo[e]indole-3-carboxylate Openeye Name: tert-butyl (1S)-5-hydroxy-1-(methoxymethyl)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylate CAS Name: (1S)-5-hydroxy-1-(methoxymethyl)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S)-5-hydroxy-1-(methoxymethyl)-4-methyl-1,2-dihydrobenzo[e]indole-3-carboxylate Traditional Name: (1S)-5-hydroxy-1-(methoxymethyl)-4-methyl-1,2-dihydrobenz[e]indole-3-carboxylic acid tert-butyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C3=C1N(CC3COC)C(=O)OC(C)(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO4/c1-12-17-16(14-8-6-7-9-15(14)18(12)22)13(11-24-5)10-21(17)19(23)25-20(2,3)4/h6-9,13,22H,10-11H2,1-5H3/t13-/m0/s1