[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[2-(2-methylphenoxy)ethyl]azanium

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[2-(2-methylphenoxy)ethyl]azanium Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl]-ethyl-[2-(2-methylphenoxy)ethyl]ammonium CAS Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-[2-(2-methylphenoxy)ethyl]ammonium IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-[2-(2-methylphenoxy)ethyl]azanium Traditional Name: [2-(4-acetamidoanilino)-2-keto-ethyl]-ethyl-[2-(2-methylphenoxy)ethyl]ammonium Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCOC1=CC=CC=C1C)CC(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC[NH+](CCOC1=CC=CC=C1C)CC(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H27N3O3/c1-4-24(13-14-27-20-8-6-5-7-16(20)2)15-21(26)23-19-11-9-18(10-12-19)22-17(3)25/h5-12H,4,13-15H2,1-3H3,(H,22,25)(H,23,26)/p+1