6-methyl-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]carbonyl-chromen-4-one

Systemtic Name: 6-methyl-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]carbonyl-chromen-4-one Openeye Name: 6-methyl-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-carbonyl]chromen-4-one CAS Name: 6-methyl-2-[oxo-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 6-methyl-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-carbonyl]chromen-4-one Traditional Name: 6-methyl-2-[4-(2-phenoxyethyl)piperazin-4-ium-1-carbonyl]chromone Formula: C23H25N2O4+ MolecularWeight: 393.4556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)N3CC[NH+](CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)N3CC[NH+](CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C23H24N2O4/c1-17-7-8-21-19(15-17)20(26)16-22(29-21)23(27)25-11-9-24(10-12-25)13-14-28-18-5-3-2-4-6-18/h2-8,15-16H,9-14H2,1H3/p+1