(2R)-3-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-(phenylcarbamoylamino)butanamide

Systemtic Name: (2R)-3-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-(phenylcarbamoylamino)butanamide Openeye Name: (2R)-3-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-(phenylcarbamoylamino)butanamide CAS Name: (2R)-2-[[anilino(oxo)methyl]amino]-3-methyl-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]butanamide IUPAC Name: (2R)-3-methyl-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-2-(phenylcarbamoylamino)butanamide Traditional Name: (2R)-3-methyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-(phenylcarbamoylamino)butyramide Formula: C20H33N4O3+ MolecularWeight: 377.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(C)(C)[NH+]1CCOCC1)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@H](C(=O)NCC(C)(C)[NH+]1CCOCC1)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H32N4O3/c1-15(2)17(23-19(26)22-16-8-6-5-7-9-16)18(25)21-14-20(3,4)24-10-12-27-13-11-24/h5-9,15,17H,10-14H2,1-4H3,(H,21,25)(H2,22,23,26)/p+1/t17-/m1/s1