[(1R)-2-[(4-butoxy-3-methoxy-phenyl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(4-butoxy-3-methoxy-phenyl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(4-butoxy-3-methoxy-benzoyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(4-butoxy-3-methoxyphenyl)-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(4-butoxy-3-methoxybenzoyl)amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(4-butoxy-3-methoxy-benzoyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C20H29N2O3S+ MolecularWeight: 377.52086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NCC(C2=CSC=C2)[NH+](C)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC[C@@H](C2=CSC=C2)[NH+](C)C)OC

InChI

InChI=1S/C20H28N2O3S/c1-5-6-10-25-18-8-7-15(12-19(18)24-4)20(23)21-13-17(22(2)3)16-9-11-26-14-16/h7-9,11-12,14,17H,5-6,10,13H2,1-4H3,(H,21,23)/p+1/t17-/m0/s1