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

Systemtic Name: ethyl (4R)-2-azanyl-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl (4R)-2-amino-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: (4R)-2-amino-4-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-2-amino-4-(1-ethyl-3,5-dimethylpyrazol-4-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: (4R)-2-amino-4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-5-keto-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C2C3=C(CCCC3=O)OC(=C2C(=O)OCC)N)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)[C@@H]2C3=C(CCCC3=O)OC(=C2C(=O)OCC)N)C

InChI

InChI=1S/C19H25N3O4/c1-5-22-11(4)14(10(3)21-22)16-15-12(23)8-7-9-13(15)26-18(20)17(16)19(24)25-6-2/h16H,5-9,20H2,1-4H3/t16-/m1/s1