(2S)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-phenyl-pentanamide

Systemtic Name: (2S)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-phenyl-pentanamide Openeye Name: (2S)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-phenyl-pentanamide CAS Name: (2S)-N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-phenylpentanamide IUPAC Name: (2S)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-phenylpentanamide Traditional Name: (2S)-N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]-2-phenyl-valeramide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C23H30N2O2/c1-2-6-22(21-7-4-3-5-8-21)23(26)24-17-19-9-11-20(12-10-19)18-25-13-15-27-16-14-25/h3-5,7-12,22H,2,6,13-18H2,1H3,(H,24,26)/p+1/t22-/m0/s1