(3R)-3-(10-thiophen-3-yldecanoylamino)-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-(10-thiophen-3-yldecanoylamino)-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-[10-(3-thienyl)decanoylamino]-4-(trimethylammonio)butanoate CAS Name: (3R)-3-[[1-oxo-10-(3-thiophenyl)decyl]amino]-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-(10-thiophen-3-yldecanoylamino)-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-[10-(3-thienyl)decanoylamino]-4-(trimethylammonio)butyrate Formula: C21H36N2O3S MolecularWeight: 396.58714

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)[O-])NC(=O)CCCCCCCCCC1=CSC=C1

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)[O-])NC(=O)CCCCCCCCCC1=CSC=C1

InChI

InChI=1S/C21H36N2O3S/c1-23(2,3)16-19(15-21(25)26)22-20(24)12-10-8-6-4-5-7-9-11-18-13-14-27-17-18/h13-14,17,19H,4-12,15-16H2,1-3H3,(H-,22,24,25,26)/t19-/m1/s1