3-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(4-isopropylbenzoyl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[oxo-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[4-(4-propan-2-ylbenzoyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-(4-cumoylpiperazine-1-carbonyl)benzonitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H23N3O2/c1-16(2)18-6-8-19(9-7-18)21(26)24-10-12-25(13-11-24)22(27)20-5-3-4-17(14-20)15-23/h3-9,14,16H,10-13H2,1-2H3