ethyl N-[(3S)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]carbamate

Systemtic Name: ethyl N-[(3S)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]carbamate Openeye Name: ethyl N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]carbamate CAS Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]carbamate Traditional Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]carbamic acid ethyl ester Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O

Isomeric SMILES

CCOC(=O)NC1[C@@H](C(OC2=C1C=C(C=C2)C#N)(C)C)O

InChI

InChI=1S/C15H18N2O4/c1-4-20-14(19)17-12-10-7-9(8-16)5-6-11(10)21-15(2,3)13(12)18/h5-7,12-13,18H,4H2,1-3H3,(H,17,19)/t12?,13-/m0/s1