1-[2-[(4-chloranylphenoxy)methyl]-1-methyl-indol-3-yl]-2-(2-phenylpiperazin-1-yl)ethanone

Systemtic Name: 1-[2-[(4-chloranylphenoxy)methyl]-1-methyl-indol-3-yl]-2-(2-phenylpiperazin-1-yl)ethanone Openeye Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methyl-indol-3-yl]-2-(2-phenylpiperazin-1-yl)ethanone CAS Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methyl-3-indolyl]-2-(2-phenyl-1-piperazinyl)ethanone IUPAC Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methylindol-3-yl]-2-(2-phenylpiperazin-1-yl)ethanone Traditional Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methyl-indol-3-yl]-2-(2-phenylpiperazino)ethanone Formula: C28H28ClN3O2 MolecularWeight: 473.99382

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)C(=O)CN4CCNCC4C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)C(=O)CN4CCNCC4C5=CC=CC=C5

InChI

InChI=1S/C28H28ClN3O2/c1-31-24-10-6-5-9-23(24)28(26(31)19-34-22-13-11-21(29)12-14-22)27(33)18-32-16-15-30-17-25(32)20-7-3-2-4-8-20/h2-14,25,30H,15-19H2,1H3