[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: [4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(3-isopropoxypropyl)ammonium CAS Name: [4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: [4-(4-chlorobenzyl)oxy-3-methoxy-benzyl]-(3-isopropoxypropyl)ammonium Formula: C21H29ClNO3+ MolecularWeight: 378.91286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClNO3/c1-16(2)25-12-4-11-23-14-18-7-10-20(21(13-18)24-3)26-15-17-5-8-19(22)9-6-17/h5-10,13,16,23H,4,11-12,14-15H2,1-3H3/p+1