N-[2-(2-azanyl-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide CAS Name: N-[2-(2-amino-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide Traditional Name: N-[2-(2-amino-2-keto-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]propionamide Formula: C14H19N3O2 MolecularWeight: 261.31956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(CCN(C2)CC(=O)N)C=C1

Isomeric SMILES

CCC(=O)NC1=CC2=C(CCN(C2)CC(=O)N)C=C1

InChI

InChI=1S/C14H19N3O2/c1-2-14(19)16-12-4-3-10-5-6-17(9-13(15)18)8-11(10)7-12/h3-4,7H,2,5-6,8-9H2,1H3,(H2,15,18)(H,16,19)