[3-(1-methoxy-1-oxidanylidene-propan-2-yl)-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrol-2-yl]methylazanium chloride

Systemtic Name: [3-(1-methoxy-1-oxidanylidene-propan-2-yl)-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrol-2-yl]methylazanium chloride Openeye Name: [3-(2-methoxy-1-methyl-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-1H-pyrrol-2-yl]methylammonium chloride CAS Name: [3-(1-methoxy-1-oxopropan-2-yl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methylammonium chloride IUPAC Name: [3-(1-methoxy-1-oxopropan-2-yl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methylazanium chloride Traditional Name: [3-(2-keto-2-methoxy-1-methyl-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrol-2-yl]methylammonium chloride Formula: C13H21ClN2O4 MolecularWeight: 304.76984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(NC=C1CCC(=O)OC)C[NH3+])C(=O)OC.[Cl-]

Isomeric SMILES

CC(C1=C(NC=C1CCC(=O)OC)C[NH3+])C(=O)OC.[Cl-]

InChI

InChI=1S/C13H20N2O4.ClH/c1-8(13(17)19-3)12-9(4-5-11(16)18-2)7-15-10(12)6-14;/h7-8,15H,4-6,14H2,1-3H3;1H