(7-isoquinolin-1-ylheptanoylamino) propanoate

Systemtic Name: (7-isoquinolin-1-ylheptanoylamino) propanoate Openeye Name: [7-(1-isoquinolyl)heptanoylamino] propanoate CAS Name: propanoic acid [[7-(1-isoquinolinyl)-1-oxoheptyl]amino] ester IUPAC Name: (7-isoquinolin-1-ylheptanoylamino) propanoate Traditional Name: propionic acid [7-(1-isoquinolyl)heptanoylamino] ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ONC(=O)CCCCCCC1=NC=CC2=CC=CC=C21

Isomeric SMILES

CCC(=O)ONC(=O)CCCCCCC1=NC=CC2=CC=CC=C21

InChI

InChI=1S/C19H24N2O3/c1-2-19(23)24-21-18(22)12-6-4-3-5-11-17-16-10-8-7-9-15(16)13-14-20-17/h7-10,13-14H,2-6,11-12H2,1H3,(H,21,22)