1-[7-ethyl-1-(phenylmethyl)indol-3-yl]-2-(4-phenylpiperazin-1-yl)ethane-1,2-dione

Systemtic Name: 1-[7-ethyl-1-(phenylmethyl)indol-3-yl]-2-(4-phenylpiperazin-1-yl)ethane-1,2-dione Openeye Name: 1-(1-benzyl-7-ethyl-indol-3-yl)-2-(4-phenylpiperazin-1-yl)ethane-1,2-dione CAS Name: 1-[7-ethyl-1-(phenylmethyl)-3-indolyl]-2-(4-phenyl-1-piperazinyl)ethane-1,2-dione IUPAC Name: 1-(1-benzyl-7-ethylindol-3-yl)-2-(4-phenylpiperazin-1-yl)ethane-1,2-dione Traditional Name: 1-(1-benzyl-7-ethyl-indol-3-yl)-2-(4-phenylpiperazino)ethane-1,2-dione Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N(C=C2C(=O)C(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC2=C1N(C=C2C(=O)C(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H29N3O2/c1-2-23-12-9-15-25-26(21-32(27(23)25)20-22-10-5-3-6-11-22)28(33)29(34)31-18-16-30(17-19-31)24-13-7-4-8-14-24/h3-15,21H,2,16-20H2,1H3