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

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[3-(4-methoxyphenoxy)propyl]azanium Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl]-ethyl-[3-(4-methoxyphenoxy)propyl]ammonium CAS Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-[3-(4-methoxyphenoxy)propyl]ammonium IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-[3-(4-methoxyphenoxy)propyl]azanium Traditional Name: [2-(4-acetamidoanilino)-2-keto-ethyl]-ethyl-[3-(4-methoxyphenoxy)propyl]ammonium Formula: C22H30N3O4+ MolecularWeight: 400.4913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4/c1-4-25(14-5-15-29-21-12-10-20(28-3)11-13-21)16-22(27)24-19-8-6-18(7-9-19)23-17(2)26/h6-13H,4-5,14-16H2,1-3H3,(H,23,26)(H,24,27)/p+1