azanylidyneazanium; hexan-1-amine; 2-hexoxy-1-[2-(4-methoxyphenoxy)ethyl]-3-methyl-benzene

Systemtic Name: azanylidyneazanium; hexan-1-amine; 2-hexoxy-1-[2-(4-methoxyphenoxy)ethyl]-3-methyl-benzene Openeye Name: hexan-1-amine; 2-hexoxy-1-[2-(4-methoxyphenoxy)ethyl]-3-methyl-benzene; nitridoammonium CAS Name: 1-hexanamine; 2-hexoxy-1-[2-(4-methoxyphenoxy)ethyl]-3-methylbenzene; nitriloammonium IUPAC Name: azanylidyneazanium; hexan-1-amine; 2-hexoxy-1-[2-(4-methoxyphenoxy)ethyl]-3-methylbenzene Traditional Name: 2-hexoxy-1-[2-(4-methoxyphenoxy)ethyl]-3-methyl-benzene; hexylamine; nitriloammonium Formula: C28H46N3O3+ MolecularWeight: 472.68314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN.CCCCCCOC1=C(C=CC=C1CCOC2=CC=C(C=C2)OC)C.[NH+]#N

Isomeric SMILES

CCCCCCN.CCCCCCOC1=C(C=CC=C1CCOC2=CC=C(C=C2)OC)C.[NH+]#N

InChI

InChI=1S/C22H30O3.C6H15N.N2/c1-4-5-6-7-16-25-22-18(2)9-8-10-19(22)15-17-24-21-13-11-20(23-3)12-14-21;1-2-3-4-5-6-7;1-2/h8-14H,4-7,15-17H2,1-3H3;2-7H2,1H3;/p+1