1-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-oxomethyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperazino]-2-methyl-propan-1-one Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C(C)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)C(C)C)C

InChI

InChI=1S/C21H27N3O2/c1-15(2)20(25)22-11-13-23(14-12-22)21(26)18-7-9-19(10-8-18)24-16(3)5-6-17(24)4/h5-10,15H,11-14H2,1-4H3