[(1R)-2-[4-(4-ethoxyphenoxy)butanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[4-(4-ethoxyphenoxy)butanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[4-(4-ethoxyphenoxy)butanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[4-(4-ethoxyphenoxy)-1-oxobutyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[4-(4-ethoxyphenoxy)butanoylamino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[4-(4-ethoxyphenoxy)butanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C20H29N2O3S+ MolecularWeight: 377.52086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCCC(=O)NCC(C2=CSC=C2)[NH+](C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCCC(=O)NC[C@@H](C2=CSC=C2)[NH+](C)C

InChI

InChI=1S/C20H28N2O3S/c1-4-24-17-7-9-18(10-8-17)25-12-5-6-20(23)21-14-19(22(2)3)16-11-13-26-15-16/h7-11,13,15,19H,4-6,12,14H2,1-3H3,(H,21,23)/p+1/t19-/m0/s1