3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(3-benzyloxyphenyl)-1-[4-[(E)-cinnamyl]piperazin-1-yl]-3-(7-ethyl-1H-indol-3-yl)propan-1-one CAS Name: 3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(3-benzoxyphenyl)-1-[4-[(E)-cinnamyl]piperazino]-3-(7-ethyl-1H-indol-3-yl)propan-1-one Formula: C39H41N3O2 MolecularWeight: 583.76174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4)C5=CC(=CC=C5)OCC6=CC=CC=C6

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC(=O)N3CCN(CC3)C/C=C/C4=CC=CC=C4)C5=CC(=CC=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C39H41N3O2/c1-2-32-17-10-20-35-37(28-40-39(32)35)36(33-18-9-19-34(26-33)44-29-31-14-7-4-8-15-31)27-38(43)42-24-22-41(23-25-42)21-11-16-30-12-5-3-6-13-30/h3-20,26,28,36,40H,2,21-25,27,29H2,1H3/b16-11+