4-methyl-7-[2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethoxy]chromen-2-one Openeye Name: 4-methyl-7-[2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethoxy]chromen-2-one CAS Name: 4-methyl-7-[2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]ethoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-[2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethoxy]chromen-2-one Traditional Name: 4-methyl-7-[2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]ethoxy]coumarin Formula: C20H15N3O6S MolecularWeight: 425.4146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCCSC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCCSC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O6S/c1-12-9-18(24)28-17-11-15(5-6-16(12)17)27-7-8-30-20-22-21-19(29-20)13-3-2-4-14(10-13)23(25)26/h2-6,9-11H,7-8H2,1H3