2-chloranyl-5-[(4-methoxy-3-methyl-phenyl)methylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[(4-methoxy-3-methyl-phenyl)methylamino]benzoic acid Openeye Name: 2-chloro-5-[(4-methoxy-3-methyl-phenyl)methylamino]benzoic acid CAS Name: 2-chloro-5-[(4-methoxy-3-methylphenyl)methylamino]benzoic acid IUPAC Name: 2-chloro-5-[(4-methoxy-3-methylphenyl)methylamino]benzoic acid Traditional Name: 2-chloro-5-[(4-methoxy-3-methyl-benzyl)amino]benzoic acid Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)Cl)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)Cl)C(=O)O)OC

InChI

InChI=1S/C16H16ClNO3/c1-10-7-11(3-6-15(10)21-2)9-18-12-4-5-14(17)13(8-12)16(19)20/h3-8,18H,9H2,1-2H3,(H,19,20)