methyl (4R)-2-azanyl-4-[2-(cyanomethoxy)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: methyl (4R)-2-azanyl-4-[2-(cyanomethoxy)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: methyl (4R)-2-amino-4-[2-(cyanomethoxy)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: (4R)-2-amino-4-[2-(cyanomethoxy)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4R)-2-amino-4-[2-(cyanomethoxy)phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: (4R)-2-amino-4-[2-(cyanomethoxy)phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=CC=C3OCC#N)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C(=C(O2)N)C(=O)OC)C3=CC=CC=C3OCC#N)C(=O)C1)C

InChI

InChI=1S/C21H22N2O5/c1-21(2)10-13(24)17-15(11-21)28-19(23)18(20(25)26-3)16(17)12-6-4-5-7-14(12)27-9-8-22/h4-7,16H,9-11,23H2,1-3H3/t16-/m1/s1