sodium 3-[4-[2-(diphenylmethyl)oxyethyl]piperazin-1-yl]propanoate

Systemtic Name: sodium 3-[4-[2-(diphenylmethyl)oxyethyl]piperazin-1-yl]propanoate Openeye Name: sodium 3-[4-(2-benzhydryloxyethyl)piperazin-1-yl]propanoate CAS Name: sodium 3-[4-[2-(diphenylmethyl)oxyethyl]-1-piperazinyl]propanoate IUPAC Name: sodium 3-[4-(2-benzhydryloxyethyl)piperazin-1-yl]propanoate Traditional Name: sodium 3-[4-(2-benzhydryloxyethyl)piperazino]propionate Formula: C22H27N2NaO3 MolecularWeight: 390.45115

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)[O-])CCOC(C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

Isomeric SMILES

C1CN(CCN1CCC(=O)[O-])CCOC(C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C22H28N2O3.Na/c25-21(26)11-12-23-13-15-24(16-14-23)17-18-27-22(19-7-3-1-4-8-19)20-9-5-2-6-10-20;/h1-10,22H,11-18H2,(H,25,26);/q;+1/p-1