[5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-methyl-(naphthalen-2-ylmethyl)azanium

Systemtic Name: [5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-methyl-(naphthalen-2-ylmethyl)azanium Openeye Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thienyl]methyl-methyl-(2-naphthylmethyl)ammonium CAS Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thiophenyl]methyl-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [5-amino-4-carbethoxy-2-(methylcarbamoyl)-3-thienyl]methyl-methyl-(2-naphthylmethyl)ammonium Formula: C22H26N3O3S+ MolecularWeight: 412.52514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C[NH+](C)CC2=CC3=CC=CC=C3C=C2)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C[NH+](C)CC2=CC3=CC=CC=C3C=C2)C(=O)NC)N

InChI

InChI=1S/C22H25N3O3S/c1-4-28-22(27)18-17(19(21(26)24-2)29-20(18)23)13-25(3)12-14-9-10-15-7-5-6-8-16(15)11-14/h5-11H,4,12-13,23H2,1-3H3,(H,24,26)/p+1