ethyl (1E)-N-[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-2-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-2-yl]methanimidate Openeye Name: ethyl (1E)-N-[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-2-yl]methanimidate CAS Name: (1E)-N-[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-2-yl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-2-yl]methanimidate Traditional Name: (1E)-N-[4-(4-chlorophenyl)-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-2-yl]formimidic acid ethyl ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(C(C2=C(O1)CC(CC2=O)(C)C)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCO/C=N/C1=C(C(C2=C(O1)CC(CC2=O)(C)C)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C21H21ClN2O3/c1-4-26-12-24-20-15(11-23)18(13-5-7-14(22)8-6-13)19-16(25)9-21(2,3)10-17(19)27-20/h5-8,12,18H,4,9-10H2,1-3H3/b24-12+