2-[6,7-dimethyl-3-(2-nitro-1-phenyl-ethyl)-2,3-dihydrochromen-4-ylidene]propanedinitrile

Systemtic Name: 2-[6,7-dimethyl-3-(2-nitro-1-phenyl-ethyl)-2,3-dihydrochromen-4-ylidene]propanedinitrile Openeye Name: 2-[6,7-dimethyl-3-(2-nitro-1-phenyl-ethyl)chroman-4-ylidene]propanedinitrile CAS Name: 2-[6,7-dimethyl-3-(2-nitro-1-phenylethyl)-3,4-dihydro-2H-1-benzopyran-4-ylidene]propanedinitrile IUPAC Name: 2-[6,7-dimethyl-3-(2-nitro-1-phenylethyl)-2,3-dihydrochromen-4-ylidene]propanedinitrile Traditional Name: 2-[6,7-dimethyl-3-(2-nitro-1-phenyl-ethyl)chroman-4-ylidene]malononitrile Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(C#N)C#N)C(CO2)C(C[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(C#N)C#N)C(CO2)C(C[N+](=O)[O-])C3=CC=CC=C3)C

InChI

InChI=1S/C22H19N3O3/c1-14-8-18-21(9-15(14)2)28-13-20(22(18)17(10-23)11-24)19(12-25(26)27)16-6-4-3-5-7-16/h3-9,19-20H,12-13H2,1-2H3