4-methoxy-5-oxidanylidene-1-propan-2-yl-2H-pyrrole-3-carboxylic acid

Systemtic Name: 4-methoxy-5-oxidanylidene-1-propan-2-yl-2H-pyrrole-3-carboxylic acid Openeye Name: 1-isopropyl-4-methoxy-5-oxo-2H-pyrrole-3-carboxylic acid CAS Name: 4-methoxy-5-oxo-1-propan-2-yl-2H-pyrrole-3-carboxylic acid IUPAC Name: 4-methoxy-5-oxo-1-propan-2-yl-2H-pyrrole-3-carboxylic acid Traditional Name: 1-isopropyl-5-keto-4-methoxy-3-pyrroline-3-carboxylic acid Formula: C9H13NO4 MolecularWeight: 199.20382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(=C(C1=O)OC)C(=O)O

Isomeric SMILES

CC(C)N1CC(=C(C1=O)OC)C(=O)O

InChI

InChI=1S/C9H13NO4/c1-5(2)10-4-6(9(12)13)7(14-3)8(10)11/h5H,4H2,1-3H3,(H,12,13)