4-methylbenzoic acid; pyridin-3-ylmethyl carbamate

Systemtic Name: 4-methylbenzoic acid; pyridin-3-ylmethyl carbamate Openeye Name: 4-methylbenzoic acid; 3-pyridylmethyl carbamate CAS Name: carbamic acid 3-pyridinylmethyl ester; 4-methylbenzoic acid IUPAC Name: 4-methylbenzoic acid; pyridin-3-ylmethyl carbamate Traditional Name: carbamic acid 3-pyridylmethyl ester; p-toluic acid Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8O2.C7H8N2O2/c1-6-2-4-7(5-3-6)8(9)10;8-7(10)11-5-6-2-1-3-9-4-6/h2-5H,1H3,(H,9,10);1-4H,5H2,(H2,8,10)