(2S)-1-[(4R)-5-oxidanyl-5-oxidanylidene-4-(3-phenylpropanoylamino)pentanoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: (2S)-1-[(4R)-5-oxidanyl-5-oxidanylidene-4-(3-phenylpropanoylamino)pentanoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: (2S)-1-[(4R)-5-hydroxy-5-oxo-4-(3-phenylpropanoylamino)pentanoyl]indoline-2-carboxylic acid CAS Name: (2S)-1-[(4R)-5-hydroxy-1,5-dioxo-4-[(1-oxo-3-phenylpropyl)amino]pentyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: (2S)-1-[(4R)-5-hydroxy-5-oxo-4-(3-phenylpropanoylamino)pentanoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: (2S)-1-[(4R)-4-(hydrocinnamoylamino)-5-hydroxy-5-keto-pentanoyl]indoline-2-carboxylic acid Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C21)C(=O)CCC(C(=O)O)NC(=O)CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1[C@H](N(C2=CC=CC=C21)C(=O)CC[C@H](C(=O)O)NC(=O)CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H24N2O6/c26-20(12-10-15-6-2-1-3-7-15)24-17(22(28)29)11-13-21(27)25-18-9-5-4-8-16(18)14-19(25)23(30)31/h1-9,17,19H,10-14H2,(H,24,26)(H,28,29)(H,30,31)/t17-,19+/m1/s1