2-[(3R,4R)-3-acetamido-4-(1H-indol-3-yl)-2-oxidanylidene-piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[(3R,4R)-3-acetamido-4-(1H-indol-3-yl)-2-oxidanylidene-piperidin-1-yl]ethanoic acid Openeye Name: 2-[(3R,4R)-3-acetamido-4-(1H-indol-3-yl)-2-oxo-1-piperidyl]acetic acid CAS Name: 2-[(3R,4R)-3-acetamido-4-(1H-indol-3-yl)-2-oxo-1-piperidinyl]acetic acid IUPAC Name: 2-[(3R,4R)-3-acetamido-4-(1H-indol-3-yl)-2-oxopiperidin-1-yl]acetic acid Traditional Name: 2-[(3R,4R)-3-acetamido-4-(1H-indol-3-yl)-2-keto-piperidino]acetic acid Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CCN(C1=O)CC(=O)O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](CCN(C1=O)CC(=O)O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H19N3O4/c1-10(21)19-16-12(6-7-20(17(16)24)9-15(22)23)13-8-18-14-5-3-2-4-11(13)14/h2-5,8,12,16,18H,6-7,9H2,1H3,(H,19,21)(H,22,23)/t12-,16-/m1/s1