3-carboxy-3-propan-2-yl-2-(trimethylazaniumyl)pentadecanoate

Systemtic Name: 3-carboxy-3-propan-2-yl-2-(trimethylazaniumyl)pentadecanoate Openeye Name: 3-carboxy-3-isopropyl-2-(trimethylammonio)pentadecanoate CAS Name: 3-carboxy-3-propan-2-yl-2-(trimethylammonio)pentadecanoate IUPAC Name: 3-carboxy-3-propan-2-yl-2-(trimethylazaniumyl)pentadecanoate Traditional Name: 3-carboxy-3-isopropyl-2-(trimethylammonio)pentadecanoate Formula: C22H43NO4 MolecularWeight: 385.58112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(C)C)(C(C(=O)[O-])[N+](C)(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(C(C)C)(C(C(=O)[O-])[N+](C)(C)C)C(=O)O

InChI

InChI=1S/C22H43NO4/c1-7-8-9-10-11-12-13-14-15-16-17-22(18(2)3,21(26)27)19(20(24)25)23(4,5)6/h18-19H,7-17H2,1-6H3,(H-,24,25,26,27)