3-[[5-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]-2-pyrrolidin-1-yl-phenyl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[5-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]-2-pyrrolidin-1-yl-phenyl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[5-[(4-ethoxy-4-oxo-butanoyl)amino]-2-pyrrolidin-1-yl-benzoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[5-[(4-ethoxy-1,4-dioxobutyl)amino]-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[5-[(4-ethoxy-4-oxobutanoyl)amino]-2-pyrrolidin-1-ylbenzoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[5-[(4-ethoxy-4-keto-butanoyl)amino]-2-pyrrolidino-benzoyl]amino]propyl-dimethyl-ammonium Formula: C22H35N4O4+ MolecularWeight: 419.5377

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCCC[NH+](C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C22H34N4O4/c1-4-30-21(28)11-10-20(27)24-17-8-9-19(26-14-5-6-15-26)18(16-17)22(29)23-12-7-13-25(2)3/h8-9,16H,4-7,10-15H2,1-3H3,(H,23,29)(H,24,27)/p+1