4-[[[2-morpholin-4-yl-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[2-morpholin-4-yl-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]benzoic acid Openeye Name: 4-[[(2-morpholino-3,4-dioxo-cyclobuten-1-yl)amino]methyl]benzoic acid CAS Name: 4-[[[2-(4-morpholinyl)-3,4-dioxo-1-cyclobutenyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(2-morpholin-4-yl-3,4-dioxocyclobuten-1-yl)amino]methyl]benzoic acid Traditional Name: 4-[[(3,4-diketo-2-morpholino-cyclobuten-1-yl)amino]methyl]benzoic acid Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=O)C2=O)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1COCCN1C2=C(C(=O)C2=O)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H16N2O5/c19-14-12(13(15(14)20)18-5-7-23-8-6-18)17-9-10-1-3-11(4-2-10)16(21)22/h1-4,17H,5-9H2,(H,21,22)