N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-oxo-chromene-3-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-oxochromene-3-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-keto-chromene-3-carboxamide Formula: C22H22ClN2O3+ MolecularWeight: 397.87468

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC3=CC=CC=C3OC2=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC3=CC=CC=C3OC2=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN2O3/c23-17-7-5-15(6-8-17)14-25-11-9-18(10-12-25)24-21(26)19-13-16-3-1-2-4-20(16)28-22(19)27/h1-8,13,18H,9-12,14H2,(H,24,26)/p+1