3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-(7-ethyl-1H-indol-3-yl)-1-(4-ethylpiperazino)propan-1-one Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)N3CCN(CC3)CC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC(=O)N3CCN(CC3)CC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H31N3O3/c1-3-18-6-5-7-20-22(16-27-26(18)20)21(19-8-9-23-24(14-19)32-17-31-23)15-25(30)29-12-10-28(4-2)11-13-29/h5-9,14,16,21,27H,3-4,10-13,15,17H2,1-2H3