2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]acetic acid Formula: C14H25N3O3 MolecularWeight: 283.3666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)CC(=O)O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)CC(=O)O

InChI

InChI=1S/C14H25N3O3/c18-13(17-5-3-1-2-4-6-17)11-15-7-9-16(10-8-15)12-14(19)20/h1-12H2,(H,19,20)