3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-2-ethyl-1-prop-2-ynyl-indole

Systemtic Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-2-ethyl-1-prop-2-ynyl-indole Openeye Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-2-ethyl-1-prop-2-ynyl-indole CAS Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]-2-ethyl-1-prop-2-ynylindole IUPAC Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-2-ethyl-1-prop-2-ynylindole Traditional Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]-2-ethyl-1-propargyl-indole Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N1CC#C)N3CCN(CC3)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N1CC#C)N3CCN(CC3)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C25H27N3O2/c1-3-12-28-20(4-2)24(19-8-5-6-9-21(19)28)27-15-13-26(14-16-27)22-10-7-11-23-25(22)30-18-17-29-23/h1,5-11H,4,12-18H2,2H3