7-(2-methylprop-2-enoxy)-3-piperazin-4-ium-1-ylcarbonyl-chromen-2-one

Systemtic Name: 7-(2-methylprop-2-enoxy)-3-piperazin-4-ium-1-ylcarbonyl-chromen-2-one Openeye Name: 7-(2-methylallyloxy)-3-(piperazin-4-ium-1-carbonyl)chromen-2-one CAS Name: 7-(2-methylprop-2-enoxy)-3-[oxo(1-piperazin-4-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-(2-methylprop-2-enoxy)-3-(piperazin-4-ium-1-carbonyl)chromen-2-one Traditional Name: 7-(2-methylallyloxy)-3-(piperazin-4-ium-1-carbonyl)coumarin Formula: C18H21N2O4+ MolecularWeight: 329.37034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC(=C)COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C18H20N2O4/c1-12(2)11-23-14-4-3-13-9-15(18(22)24-16(13)10-14)17(21)20-7-5-19-6-8-20/h3-4,9-10,19H,1,5-8,11H2,2H3/p+1