2,4-dimethyl-5-[(E)-(2-oxidanylidene-1H-indol-3-ylidene)methyl]-2-propanoyl-3-(1H-pyrrol-3-yl)piperazine-1-carboxylic acid

Systemtic Name: 2,4-dimethyl-5-[(E)-(2-oxidanylidene-1H-indol-3-ylidene)methyl]-2-propanoyl-3-(1H-pyrrol-3-yl)piperazine-1-carboxylic acid Openeye Name: 2,4-dimethyl-5-[(E)-(2-oxoindolin-3-ylidene)methyl]-2-propanoyl-3-(1H-pyrrol-3-yl)piperazine-1-carboxylic acid CAS Name: 2,4-dimethyl-5-[(E)-(2-oxo-1H-indol-3-ylidene)methyl]-2-(1-oxopropyl)-3-(1H-pyrrol-3-yl)-1-piperazinecarboxylic acid IUPAC Name: 2,4-dimethyl-5-[(E)-(2-oxo-1H-indol-3-ylidene)methyl]-2-propanoyl-3-(1H-pyrrol-3-yl)piperazine-1-carboxylic acid Traditional Name: 5-[(E)-(2-ketoindolin-3-ylidene)methyl]-2,4-dimethyl-2-propionyl-3-(1H-pyrrol-3-yl)piperazine-1-carboxylic acid Formula: C23H26N4O4 MolecularWeight: 422.47694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(C(N(C(CN1C(=O)O)C=C2C3=CC=CC=C3NC2=O)C)C4=CNC=C4)C

Isomeric SMILES

CCC(=O)C1(C(N(C(CN1C(=O)O)/C=C/2\C3=CC=CC=C3NC2=O)C)C4=CNC=C4)C

InChI

InChI=1S/C23H26N4O4/c1-4-19(28)23(2)20(14-9-10-24-12-14)26(3)15(13-27(23)22(30)31)11-17-16-7-5-6-8-18(16)25-21(17)29/h5-12,15,20,24H,4,13H2,1-3H3,(H,25,29)(H,30,31)/b17-11+