3-azanyl-N-[3-[1-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propyl]phenyl]propanamide

Systemtic Name: 3-azanyl-N-[3-[1-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propyl]phenyl]propanamide Openeye Name: 3-amino-N-[3-[1-(2-hydroxy-4-oxo-chromen-3-yl)propyl]phenyl]propanamide CAS Name: 3-amino-N-[3-[1-(2-hydroxy-4-oxo-1-benzopyran-3-yl)propyl]phenyl]propanamide IUPAC Name: 3-amino-N-[3-[1-(2-hydroxy-4-oxochromen-3-yl)propyl]phenyl]propanamide Traditional Name: 3-amino-N-[3-[1-(2-hydroxy-4-keto-chromen-3-yl)propyl]phenyl]propionamide Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)NC(=O)CCN)C2=C(OC3=CC=CC=C3C2=O)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)NC(=O)CCN)C2=C(OC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C21H22N2O4/c1-2-15(13-6-5-7-14(12-13)23-18(24)10-11-22)19-20(25)16-8-3-4-9-17(16)27-21(19)26/h3-9,12,15,26H,2,10-11,22H2,1H3,(H,23,24)