N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide

Systemtic Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide Openeye Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide CAS Name: N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide IUPAC Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]pentanamide Traditional Name: N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)valeramide Formula: C18H26N2O2 MolecularWeight: 302.41124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

InChI

InChI=1S/C18H26N2O2/c1-4-5-6-17(21)19-16-8-7-14-9-10-20(12-15(14)11-16)18(22)13(2)3/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,19,21)