1-(7-butoxy-1H-indol-3-yl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-(7-butoxy-1H-indol-3-yl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-(4-benzoylpiperazin-1-yl)-2-(7-butoxy-1H-indol-3-yl)ethane-1,2-dione CAS Name: 1-(4-benzoyl-1-piperazinyl)-2-(7-butoxy-1H-indol-3-yl)ethane-1,2-dione IUPAC Name: 1-(4-benzoylpiperazin-1-yl)-2-(7-butoxy-1H-indol-3-yl)ethane-1,2-dione Traditional Name: 1-(4-benzoylpiperazino)-2-(7-butoxy-1H-indol-3-yl)ethane-1,2-dione Formula: C25H27N3O4 MolecularWeight: 433.49958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC2=C1NC=C2C(=O)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=CC2=C1NC=C2C(=O)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O4/c1-2-3-16-32-21-11-7-10-19-20(17-26-22(19)21)23(29)25(31)28-14-12-27(13-15-28)24(30)18-8-5-4-6-9-18/h4-11,17,26H,2-3,12-16H2,1H3