[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: (4-benzyloxy-3,5-dichloro-phenyl)methyl-(3-isopropoxypropyl)ammonium CAS Name: (3,5-dichloro-4-phenylmethoxyphenyl)methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (3,5-dichloro-4-phenylmethoxyphenyl)methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: (4-benzoxy-3,5-dichloro-benzyl)-(3-isopropoxypropyl)ammonium Formula: C20H26Cl2NO2+ MolecularWeight: 383.33194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)OCCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)Cl

InChI

InChI=1S/C20H25Cl2NO2/c1-15(2)24-10-6-9-23-13-17-11-18(21)20(19(22)12-17)25-14-16-7-4-3-5-8-16/h3-5,7-8,11-12,15,23H,6,9-10,13-14H2,1-2H3/p+1