2,4-diphenylcyclobutane-1,3-dicarboxylate; 3-(1-ethylpyrrolidin-1-ium-1-yl)propan-1-ol; iodide

Systemtic Name: 2,4-diphenylcyclobutane-1,3-dicarboxylate; 3-(1-ethylpyrrolidin-1-ium-1-yl)propan-1-ol; iodide Openeye Name: 2,4-diphenylcyclobutane-1,3-dicarboxylate; 3-(1-ethylpyrrolidin-1-ium-1-yl)propan-1-ol; iodide CAS Name: 2,4-diphenylcyclobutane-1,3-dicarboxylate; 3-(1-ethyl-1-pyrrolidin-1-iumyl)-1-propanol; iodide IUPAC Name: 2,4-diphenylcyclobutane-1,3-dicarboxylate; 3-(1-ethylpyrrolidin-1-ium-1-yl)propan-1-ol; iodide Traditional Name: 2,4-diphenylcyclobutane-1,3-dicarboxylate; 3-(1-ethylpyrrolidin-1-ium-1-yl)propan-1-ol; iodide Formula: C27H34INO5-2 MolecularWeight: 579.46703

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCCC1)CCCO.C1=CC=C(C=C1)C2C(C(C2C(=O)[O-])C3=CC=CC=C3)C(=O)[O-].[I-]

Isomeric SMILES

CC[N+]1(CCCC1)CCCO.C1=CC=C(C=C1)C2C(C(C2C(=O)[O-])C3=CC=CC=C3)C(=O)[O-].[I-]

InChI

InChI=1S/C18H16O4.C9H20NO.HI/c19-17(20)15-13(11-7-3-1-4-8-11)16(18(21)22)14(15)12-9-5-2-6-10-12;1-2-10(8-5-9-11)6-3-4-7-10;/h1-10,13-16H,(H,19,20)(H,21,22);11H,2-9H2,1H3;1H/q;+1;/p-3