4-[[[5-[(3-chloranylphenoxy)methyl]naphthalen-2-yl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[5-[(3-chloranylphenoxy)methyl]naphthalen-2-yl]amino]methyl]benzoic acid Openeye Name: 4-[[[5-[(3-chlorophenoxy)methyl]-2-naphthyl]amino]methyl]benzoic acid CAS Name: 4-[[[5-[(3-chlorophenoxy)methyl]-2-naphthalenyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[5-[(3-chlorophenoxy)methyl]naphthalen-2-yl]amino]methyl]benzoic acid Traditional Name: 4-[[[5-[(3-chlorophenoxy)methyl]-2-naphthyl]amino]methyl]benzoic acid Formula: C25H20ClNO3 MolecularWeight: 417.8842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCC2=CC=CC3=C2C=CC(=C3)NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCC2=CC=CC3=C2C=CC(=C3)NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H20ClNO3/c26-21-5-2-6-23(14-21)30-16-20-4-1-3-19-13-22(11-12-24(19)20)27-15-17-7-9-18(10-8-17)25(28)29/h1-14,27H,15-16H2,(H,28,29)