1-[(E)-3-methoxy-1-oxidanyl-1-oxidanylidene-but-2-en-2-yl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-[(E)-3-methoxy-1-oxidanyl-1-oxidanylidene-but-2-en-2-yl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylic acid Openeye Name: 1-[(E)-1-carboxy-2-methoxy-prop-1-enyl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylic acid CAS Name: 1-[(E)-1-hydroxy-3-methoxy-1-oxobut-2-en-2-yl]-2,5-dimethyl-4-phenyl-3-pyrrolecarboxylic acid IUPAC Name: 1-[(E)-1-hydroxy-3-methoxy-1-oxobut-2-en-2-yl]-2,5-dimethyl-4-phenylpyrrole-3-carboxylic acid Traditional Name: 1-[(E)-1-carboxy-2-methoxy-prop-1-enyl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylic acid Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C(=C(C)OC)C(=O)O)C)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=C(N1/C(=C(\C)/OC)/C(=O)O)C)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO5/c1-10-14(13-8-6-5-7-9-13)15(17(20)21)11(2)19(10)16(18(22)23)12(3)24-4/h5-9H,1-4H3,(H,20,21)(H,22,23)/b16-12+