3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(1-isopropylpiperidin-1-ium-4-yl)propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-(1-isopropylpiperidin-1-ium-4-yl)propionamide Formula: C23H32N5O+ MolecularWeight: 394.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4CC[NH+](CC4)C(C)C

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4CC[NH+](CC4)C(C)C

InChI

InChI=1S/C23H31N5O/c1-15(2)27-13-11-18(12-14-27)25-22(29)10-9-19-16(3)24-23-20-7-5-6-8-21(20)26-28(23)17(19)4/h5-8,15,18H,9-14H2,1-4H3,(H,25,29)/p+1