[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(3-phenoxypropyl)azanium

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(3-phenoxypropyl)azanium Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl]-ethyl-(3-phenoxypropyl)ammonium CAS Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-(3-phenoxypropyl)ammonium IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-(3-phenoxypropyl)azanium Traditional Name: [2-(4-acetamidoanilino)-2-keto-ethyl]-ethyl-(3-phenoxypropyl)ammonium Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCOC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC[NH+](CCCOC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H27N3O3/c1-3-24(14-7-15-27-20-8-5-4-6-9-20)16-21(26)23-19-12-10-18(11-13-19)22-17(2)25/h4-6,8-13H,3,7,14-16H2,1-2H3,(H,22,25)(H,23,26)/p+1