7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]-4-phenyl-chromen-2-one

Systemtic Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]-4-phenyl-chromen-2-one Openeye Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]-4-phenyl-chromen-2-one CAS Name: 7-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-4-phenyl-1-benzopyran-2-one IUPAC Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]-4-phenylchromen-2-one Traditional Name: 7-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-4-phenyl-coumarin Formula: C22H23N2O4+ MolecularWeight: 379.42902

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O4/c1-23-9-11-24(12-10-23)21(25)15-27-17-7-8-18-19(16-5-3-2-4-6-16)14-22(26)28-20(18)13-17/h2-8,13-14H,9-12,15H2,1H3/p+1