4-methylbenzoic acid; (phenylmethyl) carbamate

Systemtic Name: 4-methylbenzoic acid; (phenylmethyl) carbamate Openeye Name: benzyl carbamate; 4-methylbenzoic acid CAS Name: carbamic acid (phenylmethyl) ester; 4-methylbenzoic acid IUPAC Name: benzyl carbamate; 4-methylbenzoic acid Traditional Name: carbamic acid benzyl ester; p-toluic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)COC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)COC(=O)N

InChI

InChI=1S/C8H9NO2.C8H8O2/c9-8(10)11-6-7-4-2-1-3-5-7;1-6-2-4-7(5-3-6)8(9)10/h1-5H,6H2,(H2,9,10);2-5H,1H3,(H,9,10)