(5-azanyl-4-ethoxycarbonyl-3-phenyl-thiophen-2-yl)methyl-diethyl-azanium

Systemtic Name: (5-azanyl-4-ethoxycarbonyl-3-phenyl-thiophen-2-yl)methyl-diethyl-azanium Openeye Name: (5-amino-4-ethoxycarbonyl-3-phenyl-2-thienyl)methyl-diethyl-ammonium CAS Name: (5-amino-4-ethoxycarbonyl-3-phenyl-2-thiophenyl)methyl-diethylammonium IUPAC Name: (5-amino-4-ethoxycarbonyl-3-phenylthiophen-2-yl)methyl-diethylazanium Traditional Name: (5-amino-4-carbethoxy-3-phenyl-2-thienyl)methyl-diethyl-ammonium Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C(=C(S1)N)C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CC1=C(C(=C(S1)N)C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C18H24N2O2S/c1-4-20(5-2)12-14-15(13-10-8-7-9-11-13)16(17(19)23-14)18(21)22-6-3/h7-11H,4-6,12,19H2,1-3H3/p+1