N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-4-oxo-chromene-2-carboxamide CAS Name: N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-4-oxochromene-2-carboxamide Traditional Name: 4-keto-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]chromene-2-carboxamide Formula: C20H21N4O3+ MolecularWeight: 365.40574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C20H20N4O3/c1-23-8-10-24(11-9-23)19-7-6-14(13-21-19)22-20(26)18-12-16(25)15-4-2-3-5-17(15)27-18/h2-7,12-13H,8-11H2,1H3,(H,22,26)/p+1