6-[3-[4-(2,2-dimethyl-3H-1-benzofuran-7-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[4-(2,2-dimethyl-3H-1-benzofuran-7-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-[4-(2,2-dimethyl-3H-benzofuran-7-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[4-(2,2-dimethyl-3H-benzofuran-7-yl)-1-piperazinyl]propyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[4-(2,2-dimethyl-3H-1-benzofuran-7-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-[4-(2,2-dimethylcoumaran-7-yl)piperazino]propyl]-4H-1,4-benzoxazin-3-one Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)N3CCN(CC3)CCCC4=CC5=C(C=C4)OCC(=O)N5)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)N3CCN(CC3)CCCC4=CC5=C(C=C4)OCC(=O)N5)C

InChI

InChI=1S/C25H31N3O3/c1-25(2)16-19-6-3-7-21(24(19)31-25)28-13-11-27(12-14-28)10-4-5-18-8-9-22-20(15-18)26-23(29)17-30-22/h3,6-9,15H,4-5,10-14,16-17H2,1-2H3,(H,26,29)