4,8-dimethyl-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4,8-dimethyl-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4,8-dimethyl-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-2-one CAS Name: 7-hydroxy-4,8-dimethyl-6-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4,8-dimethyl-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-2-one Traditional Name: 7-hydroxy-4,8-dimethyl-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]coumarin Formula: C17H24N2O3+2 MolecularWeight: 304.38406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C(C(=C(C=C12)C[NH+]3CC[NH+](CC3)C)O)C

Isomeric SMILES

CC1=CC(=O)OC2=C(C(=C(C=C12)C[NH+]3CC[NH+](CC3)C)O)C

InChI

InChI=1S/C17H22N2O3/c1-11-8-15(20)22-17-12(2)16(21)13(9-14(11)17)10-19-6-4-18(3)5-7-19/h8-9,21H,4-7,10H2,1-3H3/p+2