4-oxidanylidene-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]chromene-2-carboxamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C22H22N2O3/c25-19-13-21(27-20-6-2-1-5-18(19)20)22(26)23-14-16-7-9-17(10-8-16)15-24-11-3-4-12-24/h1-2,5-10,13H,3-4,11-12,14-15H2,(H,23,26)/p+1