N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2-oxo-chromene-3-carboxamide CAS Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2-oxochromene-3-carboxamide Traditional Name: 2-keto-N-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]chromene-3-carboxamide Formula: C23H25N2O4+ MolecularWeight: 393.4556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCCC(C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCC[C@@H](C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H24N2O4/c1-28-19-9-4-6-16(12-19)14-25-11-5-8-18(15-25)24-22(26)20-13-17-7-2-3-10-21(17)29-23(20)27/h2-4,6-7,9-10,12-13,18H,5,8,11,14-15H2,1H3,(H,24,26)/p+1/t18-/m0/s1