(2R)-2-(azepan-1-ium-1-yl)-N-(diphenylmethyl)propanamide

Systemtic Name: (2R)-2-(azepan-1-ium-1-yl)-N-(diphenylmethyl)propanamide Openeye Name: (2R)-2-(azepan-1-ium-1-yl)-N-benzhydryl-propanamide CAS Name: (2R)-2-(1-azepan-1-iumyl)-N-(diphenylmethyl)propanamide IUPAC Name: (2R)-2-(azepan-1-ium-1-yl)-N-benzhydrylpropanamide Traditional Name: (2R)-2-(azepan-1-ium-1-yl)-N-benzhydryl-propionamide Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)[NH+]3CCCCCC3

Isomeric SMILES

C[C@H](C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)[NH+]3CCCCCC3

InChI

InChI=1S/C22H28N2O/c1-18(24-16-10-2-3-11-17-24)22(25)23-21(19-12-6-4-7-13-19)20-14-8-5-9-15-20/h4-9,12-15,18,21H,2-3,10-11,16-17H2,1H3,(H,23,25)/p+1/t18-/m1/s1