4-[2-[2-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-1,2,3,4-tetrazol-5-yl]benzamide

Systemtic Name: 4-[2-[2-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-1,2,3,4-tetrazol-5-yl]benzamide Openeye Name: 4-[2-[2-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]tetrazol-5-yl]benzamide CAS Name: 4-[2-[2-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]-5-tetrazolyl]benzamide IUPAC Name: 4-[2-[2-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]tetrazol-5-yl]benzamide Traditional Name: 4-[2-[2-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl]tetrazol-5-yl]benzamide Formula: C23H20N6O4 MolecularWeight: 444.4427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)CN4N=C(N=N4)C5=CC=C(C=C5)C(=O)N

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)CN4N=C(N=N4)C5=CC=C(C=C5)C(=O)N

InChI

InChI=1S/C23H20N6O4/c1-13-9-18(14(2)29(13)17-7-8-20-21(10-17)33-12-32-20)19(30)11-28-26-23(25-27-28)16-5-3-15(4-6-16)22(24)31/h3-10H,11-12H2,1-2H3,(H2,24,31)