4-[[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4-bromo-3-methoxy-naphthalene-2-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(4-bromo-3-methoxy-2-naphthoyl)amino]methyl]benzoic acid Formula: C20H16BrNO4 MolecularWeight: 414.24934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NCC3=CC=C(C=C3)C(=O)O)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NCC3=CC=C(C=C3)C(=O)O)Br

InChI

InChI=1S/C20H16BrNO4/c1-26-18-16(10-14-4-2-3-5-15(14)17(18)21)19(23)22-11-12-6-8-13(9-7-12)20(24)25/h2-10H,11H2,1H3,(H,22,23)(H,24,25)