N-[[2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: N-[[2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: N-[[2-(4-acetylpiperazin-1-yl)-3-pyridyl]methyl]chromane-3-carboxamide CAS Name: N-[[2-(4-acetyl-1-piperazinyl)-3-pyridinyl]methyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[[2-(4-acetylpiperazin-1-yl)pyridin-3-yl]methyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: N-[[2-(4-acetylpiperazino)-3-pyridyl]methyl]chroman-3-carboxamide Formula: C22H26N4O3 MolecularWeight: 394.46684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)CNC(=O)C3CC4=CC=CC=C4OC3

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)CNC(=O)C3CC4=CC=CC=C4OC3

InChI

InChI=1S/C22H26N4O3/c1-16(27)25-9-11-26(12-10-25)21-18(6-4-8-23-21)14-24-22(28)19-13-17-5-2-3-7-20(17)29-15-19/h2-8,19H,9-15H2,1H3,(H,24,28)