(2-methoxy-5-methyl-phenyl)methyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbamoyl)phenyl]amino]ethyl]azanium

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbamoyl)phenyl]amino]ethyl]azanium Openeye Name: (2-methoxy-5-methyl-phenyl)methyl-methyl-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]ammonium CAS Name: [2-[2-[anilino(oxo)methyl]anilino]-2-oxoethyl]-[(2-methoxy-5-methylphenyl)methyl]-methylammonium IUPAC Name: (2-methoxy-5-methylphenyl)methyl-methyl-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]azanium Traditional Name: [2-keto-2-[2-(phenylcarbamoyl)anilino]ethyl]-(2-methoxy-5-methyl-benzyl)-methyl-ammonium Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+](C)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+](C)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3/c1-18-13-14-23(31-3)19(15-18)16-28(2)17-24(29)27-22-12-8-7-11-21(22)25(30)26-20-9-5-4-6-10-20/h4-15H,16-17H2,1-3H3,(H,26,30)(H,27,29)/p+1