butanedioate; ethane; 4-(2-piperidin-4-ylethoxy)benzoate

Systemtic Name: butanedioate; ethane; 4-(2-piperidin-4-ylethoxy)benzoate Openeye Name: butanedioate; ethane; 4-[2-(4-piperidyl)ethoxy]benzoate CAS Name: butanedioate; ethane; 4-[2-(4-piperidinyl)ethoxy]benzoate IUPAC Name: butanedioate; ethane; 4-(2-piperidin-4-ylethoxy)benzoate Traditional Name: ethane; 4-[2-(4-piperidyl)ethoxy]benzoate; succinate Formula: C20H28NO7-3 MolecularWeight: 394.43882

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Descriptors Computed from Structure

Canonical SMILES:

CC.C1CNCCC1CCOC2=CC=C(C=C2)C(=O)[O-].C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC.C1CNCCC1CCOC2=CC=C(C=C2)C(=O)[O-].C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H19NO3.C4H6O4.C2H6/c16-14(17)12-1-3-13(4-2-12)18-10-7-11-5-8-15-9-6-11;5-3(6)1-2-4(7)8;1-2/h1-4,11,15H,5-10H2,(H,16,17);1-2H2,(H,5,6)(H,7,8);1-2H3/p-3