6-[(4-methylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one

Systemtic Name: 6-[(4-methylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Openeye Name: 7-hydroxy-6-[(4-methylpiperazin-4-ium-1-yl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one CAS Name: 7-hydroxy-6-[(4-methyl-1-piperazin-4-iumyl)methyl]-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one IUPAC Name: 7-hydroxy-6-[(4-methylpiperazin-4-ium-1-yl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Traditional Name: 7-hydroxy-6-[(4-methylpiperazin-4-ium-1-yl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Formula: C18H23N2O3+ MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=O)C4=C3CCC4)O

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=O)C4=C3CCC4)O

InChI

InChI=1S/C18H22N2O3/c1-19-7-9-20(10-8-19)11-15-16(21)6-5-13-12-3-2-4-14(12)18(22)23-17(13)15/h5-6,21H,2-4,7-11H2,1H3/p+1