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

Systemtic Name: 3-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 1-hydroxy-3-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 1-hydroxy-3-methyl-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 1-hydroxy-3-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 1-hydroxy-3-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Formula: C21H28NO3+ MolecularWeight: 342.45192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C3=C(C=C2C)OC(=O)C4=C3CCCC4)O

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C3=C(C=C2C)OC(=O)C4=C3CCCC4)O

InChI

InChI=1S/C21H27NO3/c1-13-7-9-22(10-8-13)12-17-14(2)11-18-19(20(17)23)15-5-3-4-6-16(15)21(24)25-18/h11,13,23H,3-10,12H2,1-2H3/p+1