2-[(1-methylindol-2-yl)-pyridin-3-yl-methoxy]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(1-methylindol-2-yl)-pyridin-3-yl-methoxy]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[(1-methylindol-2-yl)-(3-pyridyl)methoxy]ethanone CAS Name: 2-[(1-methyl-2-indolyl)-(3-pyridinyl)methoxy]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[(1-methylindol-2-yl)-pyridin-3-ylmethoxy]ethanone Traditional Name: 1-(4-benzylpiperazino)-2-[(1-methylindol-2-yl)-(3-pyridyl)methoxy]ethanone Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(C3=CN=CC=C3)OCC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(C3=CN=CC=C3)OCC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2/c1-30-25-12-6-5-10-23(25)18-26(30)28(24-11-7-13-29-19-24)34-21-27(33)32-16-14-31(15-17-32)20-22-8-3-2-4-9-22/h2-13,18-19,28H,14-17,20-21H2,1H3