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

Systemtic Name: 3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one Openeye Name: 3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one CAS Name: 3-[3-[4-(1-pyrrolyl)phenyl]-1,2,4-oxadiazol-5-yl]-1-benzopyran-2-one IUPAC Name: 3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one Traditional Name: 3-[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]coumarin Formula: C21H13N3O3 MolecularWeight: 355.34622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=NC(=NO3)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=NC(=NO3)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C21H13N3O3/c25-21-17(13-15-5-1-2-6-18(15)26-21)20-22-19(23-27-20)14-7-9-16(10-8-14)24-11-3-4-12-24/h1-13H