3-[2-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzoic acid

Systemtic Name: 3-[2-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzoic acid Openeye Name: 3-[2-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzoic acid CAS Name: 3-[2-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]benzoic acid IUPAC Name: 3-[2-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzoic acid Traditional Name: 3-[4-(2-ketopyrrolidino)-2-methyl-phenyl]benzoic acid Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2=O)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2=O)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C18H17NO3/c1-12-10-15(19-9-3-6-17(19)20)7-8-16(12)13-4-2-5-14(11-13)18(21)22/h2,4-5,7-8,10-11H,3,6,9H2,1H3,(H,21,22)