[3-ethoxy-4-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [3-ethoxy-4-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [3-ethoxy-4-[2-(1-naphthylamino)-2-oxo-ethoxy]phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [3-ethoxy-4-[2-(1-naphthalenylamino)-2-oxoethoxy]phenyl]methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [3-ethoxy-4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [3-ethoxy-4-[2-keto-2-(1-naphthylamino)ethoxy]benzyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C28H37N3O4+2 MolecularWeight: 479.61108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCC[NH+]2CCOCC2)OCC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCC[NH+]2CCOCC2)OCC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H35N3O4/c1-2-34-27-19-22(20-29-13-6-14-31-15-17-33-18-16-31)11-12-26(27)35-21-28(32)30-25-10-5-8-23-7-3-4-9-24(23)25/h3-5,7-12,19,29H,2,6,13-18,20-21H2,1H3,(H,30,32)/p+2