2-oxidanylidene-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]chromene-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]chromene-3-carboxamide Openeye Name: 2-oxo-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]chromene-3-carboxamide CAS Name: 2-oxo-N-[4-(1-piperidin-1-iumylmethyl)phenyl]-1-benzopyran-3-carboxamide IUPAC Name: 2-oxo-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]chromene-3-carboxamide Traditional Name: 2-keto-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]chromene-3-carboxamide Formula: C22H23N2O3+ MolecularWeight: 363.42962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H22N2O3/c25-21(19-14-17-6-2-3-7-20(17)27-22(19)26)23-18-10-8-16(9-11-18)15-24-12-4-1-5-13-24/h2-3,6-11,14H,1,4-5,12-13,15H2,(H,23,25)/p+1