4-[(propan-2-ylcarbamoylamino)methyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-[(propan-2-ylcarbamoylamino)methyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-N-(1-propan-2-yl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-[(propan-2-ylcarbamoylamino)methyl]-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide Formula: C20H33N4O2+ MolecularWeight: 361.50162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2CC[NH+](CC2)C(C)C

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C20H32N4O2/c1-14(2)22-20(26)21-13-16-5-7-17(8-6-16)19(25)23-18-9-11-24(12-10-18)15(3)4/h5-8,14-15,18H,9-13H2,1-4H3,(H,23,25)(H2,21,22,26)/p+1