2-[1-(2-azanyl-2-oxidanylidene-ethyl)-3-(4-hydroxyphenyl)-1-(2-methylpropyl)-2-oxidanylidene-pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-[1-(2-azanyl-2-oxidanylidene-ethyl)-3-(4-hydroxyphenyl)-1-(2-methylpropyl)-2-oxidanylidene-pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: 2-[1-(2-amino-2-oxo-ethyl)-3-(4-hydroxyphenyl)-1-isobutyl-2-oxo-pyrrolidin-1-ium-3-yl]acetamide CAS Name: 2-[1-(2-amino-2-oxoethyl)-3-(4-hydroxyphenyl)-1-(2-methylpropyl)-2-oxo-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[1-(2-amino-2-oxoethyl)-3-(4-hydroxyphenyl)-1-(2-methylpropyl)-2-oxopyrrolidin-1-ium-3-yl]acetamide Traditional Name: 2-[1-(2-amino-2-keto-ethyl)-3-(4-hydroxyphenyl)-1-isobutyl-2-keto-pyrrolidin-1-ium-3-yl]acetamide Formula: C18H26N3O4+ MolecularWeight: 348.41674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+]1(CCC(C1=O)(CC(=O)N)C2=CC=C(C=C2)O)CC(=O)N

Isomeric SMILES

CC(C)C[N+]1(CCC(C1=O)(CC(=O)N)C2=CC=C(C=C2)O)CC(=O)N

InChI

InChI=1S/C18H25N3O4/c1-12(2)10-21(11-16(20)24)8-7-18(17(21)25,9-15(19)23)13-3-5-14(22)6-4-13/h3-6,12H,7-11H2,1-2H3,(H4-,19,20,22,23,24)/p+1