7-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethoxy]-4-methyl-chromen-2-one

Systemtic Name: 7-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethoxy]-4-methyl-chromen-2-one Openeye Name: 7-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethoxy]-4-methyl-chromen-2-one CAS Name: 7-[2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]ethoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethoxy]-4-methylchromen-2-one Traditional Name: 7-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethoxy]-4-methyl-coumarin Formula: C23H27N2O4+ MolecularWeight: 395.47148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H26N2O4/c1-17-15-23(26)29-22-16-20(7-8-21(17)22)28-14-13-24-9-11-25(12-10-24)18-3-5-19(27-2)6-4-18/h3-8,15-16H,9-14H2,1-2H3/p+1