N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-3,5-dimethoxy-benzamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-3,5-dimethoxy-benzamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-3,5-dimethoxybenzamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-3,5-dimethoxybenzamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-3,5-dimethoxy-benzamide Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCCC(=O)N2CCC3=CC=CC=C3C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCCC(=O)N2CCC3=CC=CC=C3C2)OC

InChI

InChI=1S/C21H24N2O4/c1-26-18-11-17(12-19(13-18)27-2)21(25)22-9-7-20(24)23-10-8-15-5-3-4-6-16(15)14-23/h3-6,11-13H,7-10,14H2,1-2H3,(H,22,25)