3-[(3-chlorophenyl)methyl-(4-methoxyphenyl)amino]propylazanium

Systemtic Name: 3-[(3-chlorophenyl)methyl-(4-methoxyphenyl)amino]propylazanium Openeye Name: 3-[N-[(3-chlorophenyl)methyl]-4-methoxy-anilino]propylammonium CAS Name: 3-[N-[(3-chlorophenyl)methyl]-4-methoxyanilino]propylammonium IUPAC Name: 3-[N-[(3-chlorophenyl)methyl]-4-methoxyanilino]propylazanium Traditional Name: 3-(N-(3-chlorobenzyl)-4-methoxy-anilino)propylammonium Formula: C17H22ClN2O+ MolecularWeight: 305.82238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC[NH3+])CC2=CC(=CC=C2)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC[NH3+])CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H21ClN2O/c1-21-17-8-6-16(7-9-17)20(11-3-10-19)13-14-4-2-5-15(18)12-14/h2,4-9,12H,3,10-11,13,19H2,1H3/p+1