5-chloranyl-3-methyl-2-(phenylmethoxycarbonylamino)benzoic acid

Systemtic Name: 5-chloranyl-3-methyl-2-(phenylmethoxycarbonylamino)benzoic acid Openeye Name: 2-(benzyloxycarbonylamino)-5-chloro-3-methyl-benzoic acid CAS Name: 5-chloro-3-methyl-2-(phenylmethoxycarbonylamino)benzoic acid IUPAC Name: 5-chloro-3-methyl-2-(phenylmethoxycarbonylamino)benzoic acid Traditional Name: 2-(benzyloxycarbonylamino)-5-chloro-3-methyl-benzoic acid Formula: C16H14ClNO4 MolecularWeight: 319.73966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Cl)C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=CC(=C1)Cl)C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H14ClNO4/c1-10-7-12(17)8-13(15(19)20)14(10)18-16(21)22-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,21)(H,19,20)