N-[4-[(2R)-4-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-2H-chromen-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[(2R)-4-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-2H-chromen-2-yl]phenyl]ethanamide Openeye Name: N-[4-[(2R)-4-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-2H-chromen-2-yl]phenyl]acetamide CAS Name: N-[4-[(2R)-4-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-2H-1-benzopyran-2-yl]phenyl]acetamide IUPAC Name: N-[4-[(2R)-4-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-2H-chromen-2-yl]phenyl]acetamide Traditional Name: N-[4-[(2R)-4-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-2H-chromen-2-yl]phenyl]acetamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2C(=C(C3=C(O2)CC(CC3=O)(C)C)N)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)[C@@H]2C(=C(C3=C(O2)CC(CC3=O)(C)C)N)C#N

InChI

InChI=1S/C20H21N3O3/c1-11(24)23-13-6-4-12(5-7-13)19-14(10-21)18(22)17-15(25)8-20(2,3)9-16(17)26-19/h4-7,19H,8-9,22H2,1-3H3,(H,23,24)/t19-/m1/s1