[3-chloranyl-5-methoxy-4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [3-chloranyl-5-methoxy-4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]phenyl]methylazanium Openeye Name: [3-chloro-4-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]-5-methoxy-phenyl]methylammonium CAS Name: [3-chloro-5-methoxy-4-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [3-chloro-5-methoxy-4-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [3-chloro-4-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]-5-methoxy-benzyl]ammonium Formula: C20H27ClNO3+ MolecularWeight: 364.88628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCOC2=C(C=C(C=C2Cl)C[NH3+])OC)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCOC2=C(C=C(C=C2Cl)C[NH3+])OC)C(C)C

InChI

InChI=1S/C20H26ClNO3/c1-13(2)17-6-5-16(9-14(17)3)24-7-8-25-20-18(21)10-15(12-22)11-19(20)23-4/h5-6,9-11,13H,7-8,12,22H2,1-4H3/p+1