[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[2-(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[2-(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl]-[2-(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(cyclopropylamino)-2-oxoethyl]-[2-(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl]-methylammonium IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl]-[2-(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl]-methylazanium Traditional Name: [2-(4-carbethoxy-2,5-dimethyl-1H-pyrrol-3-yl)-2-keto-ethyl]-[2-(cyclopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H26N3O4+ MolecularWeight: 336.40604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)C[NH+](C)CC(=O)NC2CC2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)C[NH+](C)CC(=O)NC2CC2)C)C

InChI

InChI=1S/C17H25N3O4/c1-5-24-17(23)16-11(3)18-10(2)15(16)13(21)8-20(4)9-14(22)19-12-6-7-12/h12,18H,5-9H2,1-4H3,(H,19,22)/p+1