(Z)-2-[(7-nitro-1H-indol-2-yl)carbonylamino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid

Systemtic Name: (Z)-2-[(7-nitro-1H-indol-2-yl)carbonylamino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid Openeye Name: (Z)-2-[(7-nitro-1H-indole-2-carbonyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid CAS Name: (Z)-2-[[(7-nitro-1H-indol-2-yl)-oxomethyl]amino]-5-[(3S)-2-oxo-3-pyrrolidinyl]-2-pentenoic acid IUPAC Name: (Z)-2-[(7-nitro-1H-indole-2-carbonyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid Traditional Name: (Z)-5-[(3S)-2-ketopyrrolidin-3-yl]-2-[(7-nitro-1H-indole-2-carbonyl)amino]pent-2-enoic acid Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C1CCC=C(C(=O)O)NC(=O)C2=CC3=C(N2)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CNC(=O)[C@H]1CC/C=C(/C(=O)O)\NC(=O)C2=CC3=C(N2)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6/c23-16-10(7-8-19-16)3-1-5-12(18(25)26)21-17(24)13-9-11-4-2-6-14(22(27)28)15(11)20-13/h2,4-6,9-10,20H,1,3,7-8H2,(H,19,23)(H,21,24)(H,25,26)/b12-5-/t10-/m0/s1