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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClNO3/c1-16(2)25-11-5-10-23-14-17-8-9-20(21(13-17)24-3)26-15-18-6-4-7-19(22)12-18/h4,6-9,12-13,16,23H,5,10-11,14-15H2,1-3H3/p+1