(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]ammonium CAS Name: [4-[anilino(oxo)methyl]phenyl]methyl-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[[4-(phenylcarbamoyl)phenyl]methyl]azanium Traditional Name: (4,5-dimethoxy-2-methyl-benzyl)-methyl-[4-(phenylcarbamoyl)benzyl]ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C25H28N2O3/c1-18-14-23(29-3)24(30-4)15-21(18)17-27(2)16-19-10-12-20(13-11-19)25(28)26-22-8-6-5-7-9-22/h5-15H,16-17H2,1-4H3,(H,26,28)/p+1