4-[2-(1-oxidanylidene-2,3-dihydropyrrolizin-2-yl)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(1-oxidanylidene-2,3-dihydropyrrolizin-2-yl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(1-oxo-2,3-dihydropyrrolizin-2-yl)acetyl]amino]benzoic acid CAS Name: 4-[[1-oxo-2-(1-oxo-2,3-dihydropyrrolizin-2-yl)ethyl]amino]benzoic acid IUPAC Name: 4-[[2-(1-oxo-2,3-dihydropyrrolizin-2-yl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(1-keto-2,3-dihydropyrrolizin-2-yl)acetyl]amino]benzoic acid Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CN21)CC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1C(C(=O)C2=CC=CN21)CC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H14N2O4/c19-14(17-12-5-3-10(4-6-12)16(21)22)8-11-9-18-7-1-2-13(18)15(11)20/h1-7,11H,8-9H2,(H,17,19)(H,21,22)