2-[4-[3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoyl]piperazin-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoyl]piperazin-1-yl]-N-cyclopropyl-ethanamide Openeye Name: N-cyclopropyl-2-[4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoyl]piperazin-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)-1-oxopropyl]-1-piperazinyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoyl]piperazin-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[3-(1,3-diketo-4H-isoquinolin-2-yl)propanoyl]piperazino]acetamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2CCN(CC2)C(=O)CCN3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CC1NC(=O)CN2CCN(CC2)C(=O)CCN3C(=O)CC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H26N4O4/c26-18(22-16-5-6-16)14-23-9-11-24(12-10-23)19(27)7-8-25-20(28)13-15-3-1-2-4-17(15)21(25)29/h1-4,16H,5-14H2,(H,22,26)