6-ethyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-7-oxidanyl-2-pyrrolidin-1-ium-2-yl-chromen-4-one

Systemtic Name: 6-ethyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-7-oxidanyl-2-pyrrolidin-1-ium-2-yl-chromen-4-one Openeye Name: 6-ethyl-7-hydroxy-3-(4-methylthiazol-3-ium-2-yl)-2-pyrrolidin-1-ium-2-yl-chromen-4-one CAS Name: 6-ethyl-7-hydroxy-3-(4-methyl-2-thiazol-3-iumyl)-2-(2-pyrrolidin-1-iumyl)-1-benzopyran-4-one IUPAC Name: 6-ethyl-7-hydroxy-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-2-pyrrolidin-1-ium-2-ylchromen-4-one Traditional Name: 6-ethyl-7-hydroxy-3-(4-methylthiazol-3-ium-2-yl)-2-pyrrolidin-1-ium-2-yl-chromone Formula: C19H22N2O3S+2 MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3CCC[NH2+]3)C4=[NH+]C(=CS4)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3CCC[NH2+]3)C4=[NH+]C(=CS4)C)O

InChI

InChI=1S/C19H20N2O3S/c1-3-11-7-12-15(8-14(11)22)24-18(13-5-4-6-20-13)16(17(12)23)19-21-10(2)9-25-19/h7-9,13,20,22H,3-6H2,1-2H3/p+2