(3Z)-3-[(3-nitro-4-propan-2-yl-phenyl)methylidene]thiochromen-4-one

Systemtic Name: (3Z)-3-[(3-nitro-4-propan-2-yl-phenyl)methylidene]thiochromen-4-one Openeye Name: (3Z)-3-[(4-isopropyl-3-nitro-phenyl)methylene]thiochroman-4-one CAS Name: (3Z)-3-[(3-nitro-4-propan-2-ylphenyl)methylidene]-1-benzothiopyran-4-one IUPAC Name: (3Z)-3-[(3-nitro-4-propan-2-ylphenyl)methylidene]thiochromen-4-one Traditional Name: (3Z)-3-(4-isopropyl-3-nitro-benzylidene)thiochroman-4-one Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C2CSC3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C/2\CSC3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO3S/c1-12(2)15-8-7-13(10-17(15)20(22)23)9-14-11-24-18-6-4-3-5-16(18)19(14)21/h3-10,12H,11H2,1-2H3/b14-9+