8-methoxy-3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one

Systemtic Name: 8-methoxy-3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one Openeye Name: 8-methoxy-3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one CAS Name: 8-methoxy-3-[3-[4-(1-pyrrolyl)phenyl]-1,2,4-oxadiazol-5-yl]-1-benzopyran-2-one IUPAC Name: 8-methoxy-3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one Traditional Name: 8-methoxy-3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]coumarin Formula: C22H15N3O4 MolecularWeight: 385.3722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C3=NC(=NO3)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C3=NC(=NO3)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C22H15N3O4/c1-27-18-6-4-5-15-13-17(22(26)28-19(15)18)21-23-20(24-29-21)14-7-9-16(10-8-14)25-11-2-3-12-25/h2-13H,1H3