2-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethanoyl]indol-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethanoyl]indol-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-acetyl]indol-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,2-dioxoethyl]-1-indolyl]-N,N-diethylacetamide IUPAC Name: 2-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetyl]indol-1-yl]-N,N-diethylacetamide Traditional Name: 2-[3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-acetyl]indol-1-yl]-N,N-diethyl-acetamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C=C(C2=CC=CC=C21)C(=O)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCN(CC)C(=O)CN1C=C(C2=CC=CC=C21)C(=O)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H27N3O3/c1-3-26(4-2)23(29)17-28-16-21(20-11-7-8-12-22(20)28)24(30)25(31)27-14-13-18-9-5-6-10-19(18)15-27/h5-12,16H,3-4,13-15,17H2,1-2H3