[2-(4-chlorophenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [2-(4-chlorophenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [2-(4-chlorophenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [2-(4-chlorophenyl)-1-benzopyran-4-ylidene]-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [2-(4-chlorophenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [2-(4-chlorophenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C22H25ClN2O+2 MolecularWeight: 368.8997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[N+](=C2C=C(OC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

C[NH+]1CCC(CC1)[N+](=C2C=C(OC3=CC=CC=C32)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H24ClN2O/c1-24-13-11-18(12-14-24)25(2)20-15-22(16-7-9-17(23)10-8-16)26-21-6-4-3-5-19(20)21/h3-10,15,18H,11-14H2,1-2H3/q+1/p+1