2-azanyl-4-(phenoxymethyl)-5-phenylmethoxy-benzoic acid

Systemtic Name: 2-azanyl-4-(phenoxymethyl)-5-phenylmethoxy-benzoic acid Openeye Name: 2-amino-5-benzyloxy-4-(phenoxymethyl)benzoic acid CAS Name: 2-amino-4-(phenoxymethyl)-5-phenylmethoxybenzoic acid IUPAC Name: 2-amino-4-(phenoxymethyl)-5-phenylmethoxybenzoic acid Traditional Name: 2-amino-5-benzoxy-4-(phenoxymethyl)benzoic acid Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C(=C2)C(=O)O)N)COC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C(=C2)C(=O)O)N)COC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4/c22-19-11-16(14-25-17-9-5-2-6-10-17)20(12-18(19)21(23)24)26-13-15-7-3-1-4-8-15/h1-12H,13-14,22H2,(H,23,24)