ethyl 4-[(4R)-2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(4R)-2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(4R)-2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(4R)-2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4R)-2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(4R)-2-amino-3-cyano-5-keto-4,6,7,8-tetrahydrochromen-4-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)[C@@H]2C(=C(OC3=C2C(=O)CCC3)N)C#N)C

InChI

InChI=1S/C19H21N3O4/c1-4-25-19(24)17-9(2)14(10(3)22-17)15-11(8-20)18(21)26-13-7-5-6-12(23)16(13)15/h15,22H,4-7,21H2,1-3H3/t15-/m0/s1