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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C(C(=C(C=C12)CN3CC[NH+](CC3)C)O)C

Isomeric SMILES

CCC1=CC(=O)OC2=C(C(=C(C=C12)CN3CC[NH+](CC3)C)O)C

InChI

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