1-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-oxo-indolin-1-yl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxo-1-indolyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxoindol-1-yl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-keto-indolin-1-yl]methyl]proline Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C=C2C3=CC=CC=C3N(C2=O)CN4CCCC4C(=O)O)C

Isomeric SMILES

CC1=CC(=C(N1)/C=C/2\C3=CC=CC=C3N(C2=O)CN4CCCC4C(=O)O)C

InChI

InChI=1S/C21H23N3O3/c1-13-10-14(2)22-17(13)11-16-15-6-3-4-7-18(15)24(20(16)25)12-23-9-5-8-19(23)21(26)27/h3-4,6-7,10-11,19,22H,5,8-9,12H2,1-2H3,(H,26,27)/b16-11+