1-[1-(cyclohexylmethyl)indol-3-yl]-2-[4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-[1-(cyclohexylmethyl)indol-3-yl]-2-[4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-(4-benzoylpiperazin-1-yl)-2-[1-(cyclohexylmethyl)indol-3-yl]ethane-1,2-dione CAS Name: 1-(4-benzoyl-1-piperazinyl)-2-[1-(cyclohexylmethyl)-3-indolyl]ethane-1,2-dione IUPAC Name: 1-(4-benzoylpiperazin-1-yl)-2-[1-(cyclohexylmethyl)indol-3-yl]ethane-1,2-dione Traditional Name: 1-(4-benzoylpiperazino)-2-[1-(cyclohexylmethyl)indol-3-yl]ethane-1,2-dione Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(C3=CC=CC=C32)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CN2C=C(C3=CC=CC=C32)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H31N3O3/c32-26(28(34)30-17-15-29(16-18-30)27(33)22-11-5-2-6-12-22)24-20-31(19-21-9-3-1-4-10-21)25-14-8-7-13-23(24)25/h2,5-8,11-14,20-21H,1,3-4,9-10,15-19H2