2-(4-methoxyphenyl)ethanoyl-methyl-(methylcarbamoyl)-[3-(sulfonylamino)butyl]azanium

Systemtic Name: 2-(4-methoxyphenyl)ethanoyl-methyl-(methylcarbamoyl)-[3-(sulfonylamino)butyl]azanium Openeye Name: [2-(4-methoxyphenyl)acetyl]-methyl-(methylcarbamoyl)-[3-(sulfonylamino)butyl]ammonium CAS Name: [2-(4-methoxyphenyl)-1-oxoethyl]-methyl-(methylcarbamoyl)-[3-(sulfonylamino)butyl]ammonium IUPAC Name: [2-(4-methoxyphenyl)acetyl]-methyl-(methylcarbamoyl)-[3-(sulfonylamino)butyl]azanium Traditional Name: [2-(4-methoxyphenyl)acetyl]-methyl-(methylcarbamoyl)-[3-(sulfonylamino)butyl]ammonium Formula: C16H24N3O5S+ MolecularWeight: 370.44386

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[N+](C)(C(=O)CC1=CC=C(C=C1)OC)C(=O)NC)N=S(=O)=O

Isomeric SMILES

CC(CC[N+](C)(C(=O)CC1=CC=C(C=C1)OC)C(=O)NC)N=S(=O)=O

InChI

InChI=1S/C16H23N3O5S/c1-12(18-25(22)23)9-10-19(3,16(21)17-2)15(20)11-13-5-7-14(24-4)8-6-13/h5-8,12H,9-11H2,1-4H3/p+1