[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate

Systemtic Name: [2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate Openeye Name: [2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl] 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate CAS Name: 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoic acid [2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl] 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate Traditional Name: 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoic acid [2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)COC(=O)C2=CC=C(C=C2)C3=NC(=NO3)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)COC(=O)C2=CC=C(C=C2)C3=NC(=NO3)C)C

InChI

InChI=1S/C21H23N3O4/c1-5-10-24-13(2)11-18(14(24)3)19(25)12-27-21(26)17-8-6-16(7-9-17)20-22-15(4)23-28-20/h6-9,11H,5,10,12H2,1-4H3