N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzamide Formula: C20H33N4O3+ MolecularWeight: 377.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC(C)(C)[NH+]2CCOCC2

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC(C)(C)[NH+]2CCOCC2

InChI

InChI=1S/C20H32N4O3/c1-15(2)23-19(26)21-13-16-5-7-17(8-6-16)18(25)22-14-20(3,4)24-9-11-27-12-10-24/h5-8,15H,9-14H2,1-4H3,(H,22,25)(H2,21,23,26)/p+1