dimethyl-(3-phenoxypropyl)-phenyl-azanium; 3-oxidanylnaphthalene-2-carboxylic acid

Systemtic Name: dimethyl-(3-phenoxypropyl)-phenyl-azanium; 3-oxidanylnaphthalene-2-carboxylic acid Openeye Name: dimethyl-(3-phenoxypropyl)-phenyl-ammonium; 3-hydroxynaphthalene-2-carboxylic acid CAS Name: dimethyl-(3-phenoxypropyl)-phenylammonium; 3-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: dimethyl-(3-phenoxypropyl)-phenylazanium; 3-hydroxynaphthalene-2-carboxylic acid Traditional Name: dimethyl-(3-phenoxypropyl)-phenyl-ammonium; 3-hydroxy-2-naphthoic acid Formula: C28H30NO4+ MolecularWeight: 444.5421

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCOC1=CC=CC=C1)C2=CC=CC=C2.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)O

Isomeric SMILES

C[N+](C)(CCCOC1=CC=CC=C1)C2=CC=CC=C2.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)O

InChI

InChI=1S/C17H22NO.C11H8O3/c1-18(2,16-10-5-3-6-11-16)14-9-15-19-17-12-7-4-8-13-17;12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h3-8,10-13H,9,14-15H2,1-2H3;1-6,12H,(H,13,14)/q+1;