sodium 3-[4-[2-[(2-ethoxyphenyl)carbamoyloxy]ethyl]piperazin-1-yl]benzoate

Systemtic Name: sodium 3-[4-[2-[(2-ethoxyphenyl)carbamoyloxy]ethyl]piperazin-1-yl]benzoate Openeye Name: sodium 3-[4-[2-[(2-ethoxyphenyl)carbamoyloxy]ethyl]piperazin-1-yl]benzoate CAS Name: sodium 3-[4-[2-[(2-ethoxyanilino)-oxomethoxy]ethyl]-1-piperazinyl]benzoate IUPAC Name: sodium 3-[4-[2-[(2-ethoxyphenyl)carbamoyloxy]ethyl]piperazin-1-yl]benzoate Traditional Name: sodium 3-[4-[2-(o-phenetylcarbamoyloxy)ethyl]piperazino]benzoate Formula: C22H26N3NaO5 MolecularWeight: 435.44871

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)C3=CC=CC(=C3)C(=O)[O-].[Na+]

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)C3=CC=CC(=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C22H27N3O5.Na/c1-2-29-20-9-4-3-8-19(20)23-22(28)30-15-14-24-10-12-25(13-11-24)18-7-5-6-17(16-18)21(26)27;/h3-9,16H,2,10-15H2,1H3,(H,23,28)(H,26,27);/q;+1/p-1