4-[1-methyl-7-(oxan-4-ylmethylamino)-2-phenyl-indol-5-yl]piperazin-2-one

Systemtic Name: 4-[1-methyl-7-(oxan-4-ylmethylamino)-2-phenyl-indol-5-yl]piperazin-2-one Openeye Name: 4-[1-methyl-2-phenyl-7-(tetrahydropyran-4-ylmethylamino)indol-5-yl]piperazin-2-one CAS Name: 4-[1-methyl-7-(4-oxanylmethylamino)-2-phenyl-5-indolyl]-2-piperazinone IUPAC Name: 4-[1-methyl-7-(oxan-4-ylmethylamino)-2-phenylindol-5-yl]piperazin-2-one Traditional Name: 4-[1-methyl-2-phenyl-7-(tetrahydropyran-4-ylmethylamino)indol-5-yl]piperazin-2-one Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=CC(=CC(=C21)NCC3CCOCC3)N4CCNC(=O)C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=CC2=CC(=CC(=C21)NCC3CCOCC3)N4CCNC(=O)C4)C5=CC=CC=C5

InChI

InChI=1S/C25H30N4O2/c1-28-23(19-5-3-2-4-6-19)14-20-13-21(29-10-9-26-24(30)17-29)15-22(25(20)28)27-16-18-7-11-31-12-8-18/h2-6,13-15,18,27H,7-12,16-17H2,1H3,(H,26,30)