2-[(3,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(3,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)carbamoyl]benzoic acid Openeye Name: 2-[(3,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)carbamoyl]benzoic acid CAS Name: 2-[oxo-[(3,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)amino]methyl]benzoic acid IUPAC Name: 2-[(3,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)carbamoyl]benzoic acid Traditional Name: 2-[(3,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)carbamoyl]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C1C(CC(C2)(C)C)NC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=COC2=C1C(CC(C2)(C)C)NC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H21NO4/c1-11-10-24-15-9-19(2,3)8-14(16(11)15)20-17(21)12-6-4-5-7-13(12)18(22)23/h4-7,10,14H,8-9H2,1-3H3,(H,20,21)(H,22,23)