2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)ethanone

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)ethanone Openeye Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)ethanone IUPAC Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)ethanone Traditional Name: 2-[4-(4-chlorobenzoyl)piperazino]-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C22H28ClN3O2 MolecularWeight: 401.92962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O2/c1-15(2)26-16(3)13-20(17(26)4)21(27)14-24-9-11-25(12-10-24)22(28)18-5-7-19(23)8-6-18/h5-8,13,15H,9-12,14H2,1-4H3