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

Systemtic Name: 2-[(6,6-dimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)carbamoyl]benzoic acid Openeye Name: 2-[(6,6-dimethyl-5,7-dihydro-4H-benzofuran-4-yl)carbamoyl]benzoic acid CAS Name: 2-[[(6,6-dimethyl-5,7-dihydro-4H-benzofuran-4-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(6,6-dimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)carbamoyl]benzoic acid Traditional Name: 2-[(6,6-dimethyl-5,7-dihydro-4H-benzofuran-4-yl)carbamoyl]benzoic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C1)OC=C2)NC(=O)C3=CC=CC=C3C(=O)O)C

Isomeric SMILES

CC1(CC(C2=C(C1)OC=C2)NC(=O)C3=CC=CC=C3C(=O)O)C

InChI

InChI=1S/C18H19NO4/c1-18(2)9-14(13-7-8-23-15(13)10-18)19-16(20)11-5-3-4-6-12(11)17(21)22/h3-8,14H,9-10H2,1-2H3,(H,19,20)(H,21,22)