4-[[3-methyl-2,5-bis(oxidanylidene)-3-propan-2-yl-pyrrolidin-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[3-methyl-2,5-bis(oxidanylidene)-3-propan-2-yl-pyrrolidin-1-yl]methyl]benzoic acid Openeye Name: 4-[(3-isopropyl-3-methyl-2,5-dioxo-pyrrolidin-1-yl)methyl]benzoic acid CAS Name: 4-[(3-methyl-2,5-dioxo-3-propan-2-yl-1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 4-[(3-methyl-2,5-dioxo-3-propan-2-ylpyrrolidin-1-yl)methyl]benzoic acid Traditional Name: 4-[(3-isopropyl-2,5-diketo-3-methyl-pyrrolidino)methyl]benzoic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CC(C)C1(CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C16H19NO4/c1-10(2)16(3)8-13(18)17(15(16)21)9-11-4-6-12(7-5-11)14(19)20/h4-7,10H,8-9H2,1-3H3,(H,19,20)