tert-butyl 2-[[(3R,4S)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]amino]ethanoate

Systemtic Name: tert-butyl 2-[[(3R,4S)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]amino]ethanoate Openeye Name: tert-butyl 2-[[(3R,4S)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]amino]acetate CAS Name: 2-[[(3R,4S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[(3R,4S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]amino]acetate Traditional Name: 2-[[(3R,4S)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]amino]acetic acid tert-butyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NCC(=O)OC(C)(C)C)O)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=C(O1)C=CC(=C2)C#N)NCC(=O)OC(C)(C)C)O)C

InChI

InChI=1S/C18H24N2O4/c1-17(2,3)24-14(21)10-20-15-12-8-11(9-19)6-7-13(12)23-18(4,5)16(15)22/h6-8,15-16,20,22H,10H2,1-5H3/t15-,16+/m0/s1