3,4,5-trimethoxy-N-[(2S)-2-(4-methylpiperazin-1-yl)-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(2S)-2-(4-methylpiperazin-1-yl)-2-pyridin-3-yl-ethyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(2S)-2-(4-methylpiperazin-1-yl)-2-(3-pyridyl)ethyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[(2S)-2-(4-methyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(2S)-2-(4-methylpiperazin-1-yl)-2-pyridin-3-ylethyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[(2S)-2-(4-methylpiperazino)-2-(3-pyridyl)ethyl]benzamide Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C3=CN=CC=C3

Isomeric SMILES

CN1CCN(CC1)[C@H](CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C3=CN=CC=C3

InChI

InChI=1S/C22H30N4O4/c1-25-8-10-26(11-9-25)18(16-6-5-7-23-14-16)15-24-22(27)17-12-19(28-2)21(30-4)20(13-17)29-3/h5-7,12-14,18H,8-11,15H2,1-4H3,(H,24,27)/t18-/m1/s1