(3R)-3-(9-phenylnonanoylamino)-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-(9-phenylnonanoylamino)-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-(9-phenylnonanoylamino)-4-(trimethylammonio)butanoate CAS Name: (3R)-3-[(1-oxo-9-phenylnonyl)amino]-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-(9-phenylnonanoylamino)-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-(9-phenylnonanoylamino)-4-(trimethylammonio)butyrate Formula: C22H36N2O3 MolecularWeight: 376.53284

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)[O-])NC(=O)CCCCCCCCC1=CC=CC=C1

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)[O-])NC(=O)CCCCCCCCC1=CC=CC=C1

InChI

InChI=1S/C22H36N2O3/c1-24(2,3)18-20(17-22(26)27)23-21(25)16-12-7-5-4-6-9-13-19-14-10-8-11-15-19/h8,10-11,14-15,20H,4-7,9,12-13,16-18H2,1-3H3,(H-,23,25,26,27)/t20-/m1/s1