(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)ammonium CAS Name: (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl-[2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium Traditional Name: (2-keto-7-methoxy-chromen-4-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)ammonium Formula: C17H24N2O3+2 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC[NH+]3CCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC[NH+]3CCCC3

InChI

InChI=1S/C17H22N2O3/c1-21-14-4-5-15-13(10-17(20)22-16(15)11-14)12-18-6-9-19-7-2-3-8-19/h4-5,10-11,18H,2-3,6-9,12H2,1H3/p+2