3-methoxypropyl-[4-(4-phenylmethoxyphenoxy)butyl]azanium

Systemtic Name: 3-methoxypropyl-[4-(4-phenylmethoxyphenoxy)butyl]azanium Openeye Name: 4-(4-benzyloxyphenoxy)butyl-(3-methoxypropyl)ammonium CAS Name: 3-methoxypropyl-[4-(4-phenylmethoxyphenoxy)butyl]ammonium IUPAC Name: 3-methoxypropyl-[4-(4-phenylmethoxyphenoxy)butyl]azanium Traditional Name: 4-(4-benzoxyphenoxy)butyl-(3-methoxypropyl)ammonium Formula: C21H30NO3+ MolecularWeight: 344.4678

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH2+]CCCCOC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

COCCC[NH2+]CCCCOC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C21H29NO3/c1-23-16-7-15-22-14-5-6-17-24-20-10-12-21(13-11-20)25-18-19-8-3-2-4-9-19/h2-4,8-13,22H,5-7,14-18H2,1H3/p+1