2-[[2-(4-ethanoylpiperazin-1-yl)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-(4-ethanoylpiperazin-1-yl)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(4-acetylpiperazin-1-yl)-3,4-dioxo-cyclobuten-1-yl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-(4-acetyl-1-piperazinyl)-3,4-dioxo-1-cyclobutenyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-(4-acetylpiperazin-1-yl)-3,4-dioxocyclobuten-1-yl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(4-acetylpiperazino)-3,4-diketo-cyclobuten-1-yl]amino]-3-phenyl-propionic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H21N3O5/c1-12(23)21-7-9-22(10-8-21)16-15(17(24)18(16)25)20-14(19(26)27)11-13-5-3-2-4-6-13/h2-6,14,20H,7-11H2,1H3,(H,26,27)