1-(4-ethylpiperazin-1-yl)-3-(3-phenoxyphenyl)-3-[1-(phenylmethyl)indol-3-yl]propan-1-one

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-(3-phenoxyphenyl)-3-[1-(phenylmethyl)indol-3-yl]propan-1-one Openeye Name: 3-(1-benzylindol-3-yl)-1-(4-ethylpiperazin-1-yl)-3-(3-phenoxyphenyl)propan-1-one CAS Name: 1-(4-ethyl-1-piperazinyl)-3-(3-phenoxyphenyl)-3-[1-(phenylmethyl)-3-indolyl]-1-propanone IUPAC Name: 3-(1-benzylindol-3-yl)-1-(4-ethylpiperazin-1-yl)-3-(3-phenoxyphenyl)propan-1-one Traditional Name: 3-(1-benzylindol-3-yl)-1-(4-ethylpiperazino)-3-(3-phenoxyphenyl)propan-1-one Formula: C36H37N3O2 MolecularWeight: 543.69788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

CCN1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C36H37N3O2/c1-2-37-20-22-38(23-21-37)36(40)25-33(29-14-11-17-31(24-29)41-30-15-7-4-8-16-30)34-27-39(26-28-12-5-3-6-13-28)35-19-10-9-18-32(34)35/h3-19,24,27,33H,2,20-23,25-26H2,1H3