ethyl (4R)-2-azanyl-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: ethyl (4R)-2-azanyl-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: ethyl (4R)-2-amino-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: (4R)-2-amino-4-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-2-amino-4-(1-ethyl-3,5-dimethylpyrazol-4-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: (4R)-2-amino-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C2C3=C(CC(CC3=O)(C)C)OC(=C2C(=O)OCC)N)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)[C@@H]2C3=C(CC(CC3=O)(C)C)OC(=C2C(=O)OCC)N)C

InChI

InChI=1S/C21H29N3O4/c1-7-24-12(4)15(11(3)23-24)17-16-13(25)9-21(5,6)10-14(16)28-19(22)18(17)20(26)27-8-2/h17H,7-10,22H2,1-6H3/t17-/m1/s1