(2E)-4-(2-methoxycarbonylpyrrolidin-1-yl)-2-(naphthalen-1-ylmethylidene)-4-oxidanylidene-butanoic acid

Systemtic Name: (2E)-4-(2-methoxycarbonylpyrrolidin-1-yl)-2-(naphthalen-1-ylmethylidene)-4-oxidanylidene-butanoic acid Openeye Name: (2E)-4-(2-methoxycarbonylpyrrolidin-1-yl)-2-(1-naphthylmethylene)-4-oxo-butanoic acid CAS Name: (2E)-4-(2-methoxycarbonyl-1-pyrrolidinyl)-2-(1-naphthalenylmethylidene)-4-oxobutanoic acid IUPAC Name: (2E)-4-(2-methoxycarbonylpyrrolidin-1-yl)-2-(naphthalen-1-ylmethylidene)-4-oxobutanoic acid Traditional Name: (E)-2-[2-(2-carbomethoxypyrrolidino)-2-keto-ethyl]-3-(1-naphthyl)acrylic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)CC(=CC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C/C(=C\C2=CC=CC3=CC=CC=C32)/C(=O)O

InChI

InChI=1S/C21H21NO5/c1-27-21(26)18-10-5-11-22(18)19(23)13-16(20(24)25)12-15-8-4-7-14-6-2-3-9-17(14)15/h2-4,6-9,12,18H,5,10-11,13H2,1H3,(H,24,25)/b16-12+