N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-(2-phenylindol-1-yl)ethanamide

Systemtic Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-(2-phenylindol-1-yl)ethanamide Openeye Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-2-(2-phenylindol-1-yl)acetamide CAS Name: N-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]-2-(2-phenyl-1-indolyl)acetamide IUPAC Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-(2-phenylindol-1-yl)acetamide Traditional Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-2-(2-phenylindol-1-yl)acetamide Formula: C27H30N5O+ MolecularWeight: 440.56

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)CNC(=O)CN3C4=CC=CC=C4C=C3C5=CC=CC=C5

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)CNC(=O)CN3C4=CC=CC=C4C=C3C5=CC=CC=C5

InChI

InChI=1S/C27H29N5O/c1-30-13-15-31(16-14-30)26-12-11-21(18-28-26)19-29-27(33)20-32-24-10-6-5-9-23(24)17-25(32)22-7-3-2-4-8-22/h2-12,17-18H,13-16,19-20H2,1H3,(H,29,33)/p+1