2-[[4-[6-(3-azanylpropoxy)naphthalen-2-yl]oxyphenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-[6-(3-azanylpropoxy)naphthalen-2-yl]oxyphenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-[[6-(3-aminopropoxy)-2-naphthyl]oxy]benzoyl]amino]benzoic acid CAS Name: 2-[[[4-[[6-(3-aminopropoxy)-2-naphthalenyl]oxy]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-[6-(3-aminopropoxy)naphthalen-2-yl]oxybenzoyl]amino]benzoic acid Traditional Name: 2-[[4-[6-(3-aminopropoxy)-2-naphthoxy]benzoyl]amino]benzoic acid Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)OC3=CC4=C(C=C3)C=C(C=C4)OCCCN

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)OC3=CC4=C(C=C3)C=C(C=C4)OCCCN

InChI

InChI=1S/C27H24N2O5/c28-14-3-15-33-22-12-8-20-17-23(13-9-19(20)16-22)34-21-10-6-18(7-11-21)26(30)29-25-5-2-1-4-24(25)27(31)32/h1-2,4-13,16-17H,3,14-15,28H2,(H,29,30)(H,31,32)