3-acetamido-4-[4-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]benzoic acid

Systemtic Name: 3-acetamido-4-[4-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]benzoic acid Openeye Name: 3-acetamido-4-[4-[2-(2-methoxyethylamino)-2-oxo-ethyl]piperazin-1-yl]benzoic acid CAS Name: 3-acetamido-4-[4-[2-(2-methoxyethylamino)-2-oxoethyl]-1-piperazinyl]benzoic acid IUPAC Name: 3-acetamido-4-[4-[2-(2-methoxyethylamino)-2-oxoethyl]piperazin-1-yl]benzoic acid Traditional Name: 3-acetamido-4-[4-[2-keto-2-(2-methoxyethylamino)ethyl]piperazino]benzoic acid Formula: C18H26N4O5 MolecularWeight: 378.42284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)O)N2CCN(CC2)CC(=O)NCCOC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)O)N2CCN(CC2)CC(=O)NCCOC

InChI

InChI=1S/C18H26N4O5/c1-13(23)20-15-11-14(18(25)26)3-4-16(15)22-8-6-21(7-9-22)12-17(24)19-5-10-27-2/h3-4,11H,5-10,12H2,1-2H3,(H,19,24)(H,20,23)(H,25,26)