2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl-pyridin-2-yl-carbamic acid

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl-pyridin-2-yl-carbamic acid Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl-(2-pyridyl)carbamic acid CAS Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]propyl-(2-pyridinyl)carbamic acid IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl-pyridin-2-ylcarbamic acid Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]propyl-(2-pyridyl)carbamic acid Formula: C21H26N4O4 MolecularWeight: 398.45554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C1=CC=CC=N1)C(=O)O)N2CCN(CC2)C3=C4C(=CC=C3)OCCO4

Isomeric SMILES

CC(CN(C1=CC=CC=N1)C(=O)O)N2CCN(CC2)C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C21H26N4O4/c1-16(15-25(21(26)27)19-7-2-3-8-22-19)23-9-11-24(12-10-23)17-5-4-6-18-20(17)29-14-13-28-18/h2-8,16H,9-15H2,1H3,(H,26,27)