(Z)-2-[(6-bromanyl-2H-chromen-3-yl)carbonylamino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid

Systemtic Name: (Z)-2-[(6-bromanyl-2H-chromen-3-yl)carbonylamino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoic acid Openeye Name: (Z)-2-[(6-bromo-2H-chromene-3-carbonyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid CAS Name: (Z)-2-[[(6-bromo-2H-1-benzopyran-3-yl)-oxomethyl]amino]-5-[(3S)-2-oxo-3-pyrrolidinyl]-2-pentenoic acid IUPAC Name: (Z)-2-[(6-bromo-2H-chromene-3-carbonyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoic acid Traditional Name: (Z)-2-[(6-bromo-2H-chromene-3-carbonyl)amino]-5-[(3S)-2-ketopyrrolidin-3-yl]pent-2-enoic acid Formula: C19H19BrN2O5 MolecularWeight: 435.26856

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C1CCC=C(C(=O)O)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2

Isomeric SMILES

C1CNC(=O)[C@H]1CC/C=C(/C(=O)O)\NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2

InChI

InChI=1S/C19H19BrN2O5/c20-14-4-5-16-12(9-14)8-13(10-27-16)18(24)22-15(19(25)26)3-1-2-11-6-7-21-17(11)23/h3-5,8-9,11H,1-2,6-7,10H2,(H,21,23)(H,22,24)(H,25,26)/b15-3-/t11-/m0/s1