(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[(2-keto-7-methoxy-chromen-4-yl)methyl]ammonium Formula: C23H28N2O3+2 MolecularWeight: 380.48002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]C3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]C3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O3/c1-27-20-7-8-21-18(13-23(26)28-22(21)14-20)15-24-19-9-11-25(12-10-19)16-17-5-3-2-4-6-17/h2-8,13-14,19,24H,9-12,15-16H2,1H3/p+2