(2R)-2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)butanamide CAS Name: (2R)-2-(1-azepan-1-iumyl)-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: (2R)-2-(azepan-1-ium-1-yl)-N-mesityl-butyramide Formula: C19H31N2O+ MolecularWeight: 303.46224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1C)C)C)[NH+]2CCCCCC2

Isomeric SMILES

CC[C@H](C(=O)NC1=C(C=C(C=C1C)C)C)[NH+]2CCCCCC2

InChI

InChI=1S/C19H30N2O/c1-5-17(21-10-8-6-7-9-11-21)19(22)20-18-15(3)12-14(2)13-16(18)4/h12-13,17H,5-11H2,1-4H3,(H,20,22)/p+1/t17-/m1/s1