3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(3-cyclohexyloxypropyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(3-cyclohexyloxypropyl)propanamide Openeye Name: N-[3-(cyclohexoxy)propyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: N-(3-cyclohexyloxypropyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide IUPAC Name: N-(3-cyclohexyloxypropyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide Traditional Name: N-[3-(cyclohexoxy)propyl]-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OCCCNC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

C1CCC(CC1)OCCCNC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H28N2O4/c24-19(22-12-6-14-27-17-8-2-1-3-9-17)11-13-23-20(25)15-16-7-4-5-10-18(16)21(23)26/h4-5,7,10,17H,1-3,6,8-9,11-15H2,(H,22,24)