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

Systemtic Name: [3-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)phenyl] furan-2-carboxylate Openeye Name: [3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)phenyl] ester IUPAC Name: [3-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [3-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)phenyl] ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CC=C3)OC(=O)C4=CC=CO4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CC=C3)OC(=O)C4=CC=CO4)C(=O)C1)C

InChI

InChI=1S/C23H20N2O5/c1-23(2)10-16(26)20-18(11-23)30-21(25)15(12-24)19(20)13-5-3-6-14(9-13)29-22(27)17-7-4-8-28-17/h3-9,19H,10-11,25H2,1-2H3