3-[(4-nitrophenyl)methyl]-2-phenyl-thiochromen-4-one

Systemtic Name: 3-[(4-nitrophenyl)methyl]-2-phenyl-thiochromen-4-one Openeye Name: 3-[(4-nitrophenyl)methyl]-2-phenyl-thiochromen-4-one CAS Name: 3-[(4-nitrophenyl)methyl]-2-phenyl-1-benzothiopyran-4-one IUPAC Name: 3-[(4-nitrophenyl)methyl]-2-phenylthiochromen-4-one Traditional Name: 3-(4-nitrobenzyl)-2-phenyl-thiochromen-4-one Formula: C22H15NO3S MolecularWeight: 373.4244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3S2)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3S2)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15NO3S/c24-21-18-8-4-5-9-20(18)27-22(16-6-2-1-3-7-16)19(21)14-15-10-12-17(13-11-15)23(25)26/h1-13H,14H2