(2R)-2-acetamido-3-methyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]butanamide

Systemtic Name: (2R)-2-acetamido-3-methyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]butanamide Openeye Name: (2R)-2-acetamido-3-methyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]butanamide CAS Name: (2R)-2-acetamido-3-methyl-N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]butanamide IUPAC Name: (2R)-2-acetamido-3-methyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]butanamide Traditional Name: (2R)-2-acetamido-3-methyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]butyramide Formula: C20H32N3O2+ MolecularWeight: 346.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C(C(C)C)NC(=O)C

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)[C@@H](C(C)C)NC(=O)C

InChI

InChI=1S/C20H31N3O2/c1-14(2)19(21-16(4)24)20(25)22-18-7-5-17(6-8-18)13-23-11-9-15(3)10-12-23/h5-8,14-15,19H,9-13H2,1-4H3,(H,21,24)(H,22,25)/p+1/t19-/m1/s1