[3-chloranyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-hydroxyethyl)azanium

Systemtic Name: [3-chloranyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-hydroxyethyl)azanium Openeye Name: [3-chloro-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl-(2-hydroxyethyl)ammonium CAS Name: [3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-hydroxyethyl)ammonium IUPAC Name: [3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-hydroxyethyl)azanium Traditional Name: [3-chloro-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-(2-hydroxyethyl)ammonium Formula: C18H23ClNO3+ MolecularWeight: 336.83312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C[NH2+]CCO)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)C[NH2+]CCO)OC

InChI

InChI=1S/C18H22ClNO3/c1-13-3-5-14(6-4-13)12-23-18-16(19)9-15(10-17(18)22-2)11-20-7-8-21/h3-6,9-10,20-21H,7-8,11-12H2,1-2H3/p+1