7-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-3-phenyl-chromen-2-one

Systemtic Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-3-phenyl-chromen-2-one Openeye Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-3-phenyl-chromen-2-one CAS Name: 7-[2-(4-methyl-1-piperazin-4-iumyl)ethoxy]-3-phenyl-1-benzopyran-2-one IUPAC Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-3-phenylchromen-2-one Traditional Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-3-phenyl-coumarin Formula: C22H25N2O3+ MolecularWeight: 365.4455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCOC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)CCOC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3/c1-23-9-11-24(12-10-23)13-14-26-19-8-7-18-15-20(17-5-3-2-4-6-17)22(25)27-21(18)16-19/h2-8,15-16H,9-14H2,1H3/p+1