(2,2-dimethyl-3-oxidanyl-3H-1-benzofuran-7-yl) N-methylcarbamate; phenol

Systemtic Name: (2,2-dimethyl-3-oxidanyl-3H-1-benzofuran-7-yl) N-methylcarbamate; phenol Openeye Name: (3-hydroxy-2,2-dimethyl-3H-benzofuran-7-yl) N-methylcarbamate; phenol CAS Name: N-methylcarbamic acid (3-hydroxy-2,2-dimethyl-3H-benzofuran-7-yl) ester; phenol IUPAC Name: (3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate; phenol Traditional Name: N-methylcarbamic acid (3-hydroxy-2,2-dimethyl-coumaran-7-yl) ester; phenol Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C.C1=CC=C(C=C1)O

Isomeric SMILES

CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C.C1=CC=C(C=C1)O

InChI

InChI=1S/C12H15NO4.C6H6O/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3;7-6-4-2-1-3-5-6/h4-6,10,14H,1-3H3,(H,13,15);1-5,7H