3-acetyloxy-2-[4-(2-methylpropyl)phenyl]-4-(trimethylazaniumyl)butanoate hydrochloride

Systemtic Name: 3-acetyloxy-2-[4-(2-methylpropyl)phenyl]-4-(trimethylazaniumyl)butanoate hydrochloride Openeye Name: 3-acetoxy-2-(4-isobutylphenyl)-4-(trimethylammonio)butanoate hydrochloride CAS Name: 3-acetyloxy-2-[4-(2-methylpropyl)phenyl]-4-(trimethylammonio)butanoate hydrochloride IUPAC Name: 3-acetyloxy-2-[4-(2-methylpropyl)phenyl]-4-(trimethylazaniumyl)butanoate hydrochloride Traditional Name: 3-acetoxy-2-(4-isobutylphenyl)-4-(trimethylammonio)butyrate hydrochloride Formula: C19H30ClNO4 MolecularWeight: 371.8988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C(C[N+](C)(C)C)OC(=O)C)C(=O)[O-].Cl

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C(C[N+](C)(C)C)OC(=O)C)C(=O)[O-].Cl

InChI

InChI=1S/C19H29NO4.ClH/c1-13(2)11-15-7-9-16(10-8-15)18(19(22)23)17(24-14(3)21)12-20(4,5)6;/h7-10,13,17-18H,11-12H2,1-6H3;1H