3-(phenylmethyl)-4-(4-pyrrol-1-ylphenyl)carbonyl-piperazin-2-one

Systemtic Name: 3-(phenylmethyl)-4-(4-pyrrol-1-ylphenyl)carbonyl-piperazin-2-one Openeye Name: 3-benzyl-4-(4-pyrrol-1-ylbenzoyl)piperazin-2-one CAS Name: 4-[oxo-[4-(1-pyrrolyl)phenyl]methyl]-3-(phenylmethyl)-2-piperazinone IUPAC Name: 3-benzyl-4-(4-pyrrol-1-ylbenzoyl)piperazin-2-one Traditional Name: 3-benzyl-4-(4-pyrrol-1-ylbenzoyl)piperazin-2-one Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1CN(C(C(=O)N1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C22H21N3O2/c26-21-20(16-17-6-2-1-3-7-17)25(15-12-23-21)22(27)18-8-10-19(11-9-18)24-13-4-5-14-24/h1-11,13-14,20H,12,15-16H2,(H,23,26)