N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-2-(1-oxo-2-isoquinolyl)acetamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-2-(1-keto-2-isoquinolyl)acetamide Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CNC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CNC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H23N3O3/c23-17(20-13-18(24)21-10-5-1-2-6-11-21)14-22-12-9-15-7-3-4-8-16(15)19(22)25/h3-4,7-9,12H,1-2,5-6,10-11,13-14H2,(H,20,23)