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

Systemtic Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-2-oxidanylidene-ethyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-2-oxo-ethyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-2-oxoethyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-2-oxoethyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-2-keto-ethyl]-3,4-dimethyl-benzamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O2/c1-4-22(27-12-11-19-7-5-6-8-21(19)16-27)14-25-23(28)15-26-24(29)20-10-9-17(2)18(3)13-20/h5-10,13,22H,4,11-12,14-16H2,1-3H3,(H,25,28)(H,26,29)