3-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one

Systemtic Name: 3-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 1-hydroxy-3-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 1-hydroxy-3-methyl-2-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 1-hydroxy-3-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 1-hydroxy-3-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Formula: C20H28N2O3+2 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1C[NH+]4CC[NH+](CC4)C)O

Isomeric SMILES

CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1C[NH+]4CC[NH+](CC4)C)O

InChI

InChI=1S/C20H26N2O3/c1-13-11-17-18(14-5-3-4-6-15(14)20(24)25-17)19(23)16(13)12-22-9-7-21(2)8-10-22/h11,23H,3-10,12H2,1-2H3/p+2