[6-[2-(propan-2-ylamino)propyl]pyridin-3-yl] methanesulfonate

Systemtic Name: [6-[2-(propan-2-ylamino)propyl]pyridin-3-yl] methanesulfonate Openeye Name: [6-[2-(isopropylamino)propyl]-3-pyridyl] methanesulfonate CAS Name: methanesulfonic acid [6-[2-(propan-2-ylamino)propyl]-3-pyridinyl] ester IUPAC Name: [6-[2-(propan-2-ylamino)propyl]pyridin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [6-[2-(isopropylamino)propyl]-3-pyridyl] ester Formula: C12H20N2O3S MolecularWeight: 272.3638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C)CC1=NC=C(C=C1)OS(=O)(=O)C

Isomeric SMILES

CC(C)NC(C)CC1=NC=C(C=C1)OS(=O)(=O)C

InChI

InChI=1S/C12H20N2O3S/c1-9(2)14-10(3)7-11-5-6-12(8-13-11)17-18(4,15)16/h5-6,8-10,14H,7H2,1-4H3