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

Systemtic Name: 4-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 3-hydroxy-4-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 3-hydroxy-4-methyl-2-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 3-hydroxy-4-methyl-2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 3-hydroxy-4-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=C2C(=CC(=C1O)C[NH+]3CC[NH+](CC3)C)C4=C(CCCC4)C(=O)O2

Isomeric SMILES

CC1=C2C(=CC(=C1O)C[NH+]3CC[NH+](CC3)C)C4=C(CCCC4)C(=O)O2

InChI

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