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

Systemtic Name: 6-chloranyl-4-oxidanylidene-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]chromene-2-carboxamide Openeye Name: 6-chloro-4-oxo-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]chromene-2-carboxamide CAS Name: 6-chloro-4-oxo-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-1-benzopyran-2-carboxamide IUPAC Name: 6-chloro-4-oxo-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]chromene-2-carboxamide Traditional Name: 6-chloro-4-keto-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]chromene-2-carboxamide Formula: C22H22ClN2O3+ MolecularWeight: 397.87468

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=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C22H21ClN2O3/c23-17-7-8-20-18(11-17)19(26)12-21(28-20)22(27)24-13-15-3-5-16(6-4-15)14-25-9-1-2-10-25/h3-8,11-12H,1-2,9-10,13-14H2,(H,24,27)/p+1