tert-butyl (2S,3S,4S)-4-ethyl-1,2-dimethyl-4-oxidanyl-2,3-dihydroquinoline-3-carboxylate

Systemtic Name: tert-butyl (2S,3S,4S)-4-ethyl-1,2-dimethyl-4-oxidanyl-2,3-dihydroquinoline-3-carboxylate Openeye Name: tert-butyl (2S,3S,4S)-4-ethyl-4-hydroxy-1,2-dimethyl-2,3-dihydroquinoline-3-carboxylate CAS Name: (2S,3S,4S)-4-ethyl-4-hydroxy-1,2-dimethyl-2,3-dihydroquinoline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S,4S)-4-ethyl-4-hydroxy-1,2-dimethyl-2,3-dihydroquinoline-3-carboxylate Traditional Name: (2S,3S,4S)-4-ethyl-4-hydroxy-1,2-dimethyl-2,3-dihydroquinoline-3-carboxylic acid tert-butyl ester Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(N(C2=CC=CC=C21)C)C)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC[C@@]1([C@H]([C@@H](N(C2=CC=CC=C21)C)C)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C18H27NO3/c1-7-18(21)13-10-8-9-11-14(13)19(6)12(2)15(18)16(20)22-17(3,4)5/h8-12,15,21H,7H2,1-6H3/t12-,15+,18+/m0/s1