3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3-benzyloxyphenyl)-1-(4-benzylpiperazin-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-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(7-ethyl-1H-indol-3-yl)-3-(3-phenylmethoxyphenyl)propan-1-one Traditional Name: 3-(3-benzoxyphenyl)-1-(4-benzylpiperazino)-3-(7-ethyl-1H-indol-3-yl)propan-1-one Formula: C37H39N3O2 MolecularWeight: 557.72446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H39N3O2/c1-2-30-15-10-18-33-35(25-38-37(30)33)34(31-16-9-17-32(23-31)42-27-29-13-7-4-8-14-29)24-36(41)40-21-19-39(20-22-40)26-28-11-5-3-6-12-28/h3-18,23,25,34,38H,2,19-22,24,26-27H2,1H3