methyl-(3-oxidanylidene-3-phenylazanyl-propyl)-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium

Systemtic Name: methyl-(3-oxidanylidene-3-phenylazanyl-propyl)-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium Openeye Name: (3-anilino-3-oxo-propyl)-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium CAS Name: (3-anilino-3-oxopropyl)-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium IUPAC Name: (3-anilino-3-oxopropyl)-methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium Traditional Name: (3-anilino-3-keto-propyl)-(2-keto-2-mesidino-ethyl)-methyl-ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)CCC(=O)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)CCC(=O)NC2=CC=CC=C2)C

InChI

InChI=1S/C21H27N3O2/c1-15-12-16(2)21(17(3)13-15)23-20(26)14-24(4)11-10-19(25)22-18-8-6-5-7-9-18/h5-9,12-13H,10-11,14H2,1-4H3,(H,22,25)(H,23,26)/p+1