N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-4-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-4-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-1-methyl-3-oxo-propyl]benzamide CAS Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-4-oxobutan-2-yl]benzamide IUPAC Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-4-oxobutan-2-yl]benzamide Traditional Name: N-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-3-keto-1-methyl-propyl]benzamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CC(C)NC(=O)C1=CC=CC=C1)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC(CNC(=O)CC(C)NC(=O)C1=CC=CC=C1)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C24H31N3O2/c1-3-22(27-14-13-19-9-7-8-12-21(19)17-27)16-25-23(28)15-18(2)26-24(29)20-10-5-4-6-11-20/h4-12,18,22H,3,13-17H2,1-2H3,(H,25,28)(H,26,29)