N-[2-[[3-(2-hydroxyethyl)-4-(2-methylpropyl)piperazin-1-yl]methyl]quinolin-6-yl]ethanamide

Systemtic Name: N-[2-[[3-(2-hydroxyethyl)-4-(2-methylpropyl)piperazin-1-yl]methyl]quinolin-6-yl]ethanamide Openeye Name: N-[2-[[3-(2-hydroxyethyl)-4-isobutyl-piperazin-1-yl]methyl]-6-quinolyl]acetamide CAS Name: N-[2-[[3-(2-hydroxyethyl)-4-(2-methylpropyl)-1-piperazinyl]methyl]-6-quinolinyl]acetamide IUPAC Name: N-[2-[[3-(2-hydroxyethyl)-4-(2-methylpropyl)piperazin-1-yl]methyl]quinolin-6-yl]acetamide Traditional Name: N-[2-[[3-(2-hydroxyethyl)-4-isobutyl-piperazino]methyl]-6-quinolyl]acetamide Formula: C22H32N4O2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1CCO)CC2=NC3=C(C=C2)C=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)CN1CCN(CC1CCO)CC2=NC3=C(C=C2)C=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H32N4O2/c1-16(2)13-26-10-9-25(15-21(26)8-11-27)14-20-5-4-18-12-19(23-17(3)28)6-7-22(18)24-20/h4-7,12,16,21,27H,8-11,13-15H2,1-3H3,(H,23,28)