3-[[2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethanoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethanoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(4-butoxycarbonylanilino)-2-oxo-acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-[4-[butoxy(oxo)methyl]anilino]-1,2-dioxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(4-butoxycarbonylanilino)-2-oxoacetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(4-butoxycarbonylanilino)-2-keto-acetyl]amino]propyl-dimethyl-ammonium Formula: C18H28N3O4+ MolecularWeight: 350.43262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCCC[NH+](C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C18H27N3O4/c1-4-5-13-25-18(24)14-7-9-15(10-8-14)20-17(23)16(22)19-11-6-12-21(2)3/h7-10H,4-6,11-13H2,1-3H3,(H,19,22)(H,20,23)/p+1