N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-2-(3-methyl-1-oxo-2-isoquinolyl)acetamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-2-(3-methyl-1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-2-(3-methyl-1-oxoisoquinolin-2-yl)acetamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-2-(1-keto-3-methyl-2-isoquinolyl)acetamide Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)N3CCCCCC3

InChI

InChI=1S/C20H25N3O3/c1-15-12-16-8-4-5-9-17(16)20(26)23(15)14-18(24)21-13-19(25)22-10-6-2-3-7-11-22/h4-5,8-9,12H,2-3,6-7,10-11,13-14H2,1H3,(H,21,24)