4-nitro-N-[4-oxidanylidene-3-(3,4,5-trimethoxyphenyl)thiochromen-2-yl]benzamide

Systemtic Name: 4-nitro-N-[4-oxidanylidene-3-(3,4,5-trimethoxyphenyl)thiochromen-2-yl]benzamide Openeye Name: 4-nitro-N-[4-oxo-3-(3,4,5-trimethoxyphenyl)thiochromen-2-yl]benzamide CAS Name: 4-nitro-N-[4-oxo-3-(3,4,5-trimethoxyphenyl)-1-benzothiopyran-2-yl]benzamide IUPAC Name: 4-nitro-N-[4-oxo-3-(3,4,5-trimethoxyphenyl)thiochromen-2-yl]benzamide Traditional Name: N-[4-keto-3-(3,4,5-trimethoxyphenyl)thiochromen-2-yl]-4-nitro-benzamide Formula: C25H20N2O7S MolecularWeight: 492.5005

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H20N2O7S/c1-32-18-12-15(13-19(33-2)23(18)34-3)21-22(28)17-6-4-5-7-20(17)35-25(21)26-24(29)14-8-10-16(11-9-14)27(30)31/h4-13H,1-3H3,(H,26,29)