2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]pyrrolidin-1-yl]propanoic acid

Systemtic Name: 2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]pyrrolidin-1-yl]propanoic acid Openeye Name: 2-[(2E)-4,4-dimethyl-2-[2-oxo-2-(p-tolyl)ethylidene]pyrrolidin-1-yl]propanoic acid CAS Name: 2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxoethylidene]-1-pyrrolidinyl]propanoic acid IUPAC Name: 2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxoethylidene]pyrrolidin-1-yl]propanoic acid Traditional Name: 2-[(2E)-2-[2-keto-2-(p-tolyl)ethylidene]-4,4-dimethyl-pyrrolidino]propionic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C2CC(CN2C(C)C(=O)O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/2\CC(CN2C(C)C(=O)O)(C)C

InChI

InChI=1S/C18H23NO3/c1-12-5-7-14(8-6-12)16(20)9-15-10-18(3,4)11-19(15)13(2)17(21)22/h5-9,13H,10-11H2,1-4H3,(H,21,22)/b15-9+