3,4,8-trimethyl-6-[(4-methylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 3,4,8-trimethyl-6-[(4-methylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-3,4,8-trimethyl-6-[(4-methylpiperazin-4-ium-1-yl)methyl]chromen-2-one CAS Name: 7-hydroxy-3,4,8-trimethyl-6-[(4-methyl-1-piperazin-4-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-3,4,8-trimethyl-6-[(4-methylpiperazin-4-ium-1-yl)methyl]chromen-2-one Traditional Name: 7-hydroxy-3,4,8-trimethyl-6-[(4-methylpiperazin-4-ium-1-yl)methyl]coumarin Formula: C18H25N2O3+ MolecularWeight: 317.4027

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)CN3CC[NH+](CC3)C)O)C)C

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)CN3CC[NH+](CC3)C)O)C)C

InChI

InChI=1S/C18H24N2O3/c1-11-12(2)18(22)23-17-13(3)16(21)14(9-15(11)17)10-20-7-5-19(4)6-8-20/h9,21H,5-8,10H2,1-4H3/p+1