(Z)-2-(1H-indol-2-ylcarbonylamino)-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid

Systemtic Name: (Z)-2-(1H-indol-2-ylcarbonylamino)-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid Openeye Name: (Z)-2-(1H-indole-2-carbonylamino)-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid CAS Name: (Z)-2-[[1H-indol-2-yl(oxo)methyl]amino]-5-[(3S)-2-oxo-3-pyrrolidinyl]-2-pentenoic acid IUPAC Name: (Z)-2-(1H-indole-2-carbonylamino)-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid Traditional Name: (Z)-2-(1H-indole-2-carbonylamino)-5-[(3S)-2-ketopyrrolidin-3-yl]pent-2-enoic acid Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C1CCC=C(C(=O)O)NC(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

C1CNC(=O)[C@H]1CC/C=C(/C(=O)O)\NC(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C18H19N3O4/c22-16-11(8-9-19-16)5-3-7-14(18(24)25)21-17(23)15-10-12-4-1-2-6-13(12)20-15/h1-2,4,6-7,10-11,20H,3,5,8-9H2,(H,19,22)(H,21,23)(H,24,25)/b14-7-/t11-/m0/s1