3-methyl-5-[2-(propan-2-yloxymethyl)pyrrolidin-1-yl]carbonyl-benzoic acid

Systemtic Name: 3-methyl-5-[2-(propan-2-yloxymethyl)pyrrolidin-1-yl]carbonyl-benzoic acid Openeye Name: 3-[2-(isopropoxymethyl)pyrrolidine-1-carbonyl]-5-methyl-benzoic acid CAS Name: 3-methyl-5-[oxo-[2-(propan-2-yloxymethyl)-1-pyrrolidinyl]methyl]benzoic acid IUPAC Name: 3-methyl-5-[2-(propan-2-yloxymethyl)pyrrolidine-1-carbonyl]benzoic acid Traditional Name: 3-[2-(isopropoxymethyl)pyrrolidine-1-carbonyl]-5-methyl-benzoic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)O)C(=O)N2CCCC2COC(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)O)C(=O)N2CCCC2COC(C)C

InChI

InChI=1S/C17H23NO4/c1-11(2)22-10-15-5-4-6-18(15)16(19)13-7-12(3)8-14(9-13)17(20)21/h7-9,11,15H,4-6,10H2,1-3H3,(H,20,21)