(4-dimethylaminophenyl)methyl-methyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-methyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]-methyl-ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-methylammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-methylazanium Traditional Name: [4-(dimethylamino)benzyl]-(2-hydroxy-5-isopropyl-4-methyl-benzyl)-methyl-ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)C[NH+](C)CC2=CC=C(C=C2)N(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)C[NH+](C)CC2=CC=C(C=C2)N(C)C)O

InChI

InChI=1S/C21H30N2O/c1-15(2)20-12-18(21(24)11-16(20)3)14-23(6)13-17-7-9-19(10-8-17)22(4)5/h7-12,15,24H,13-14H2,1-6H3/p+1