1-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-3-ethyl-benzimidazol-2-one

Systemtic Name: 1-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-3-ethyl-benzimidazol-2-one Openeye Name: 1-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-3-ethyl-benzimidazol-2-one CAS Name: 1-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-3-ethyl-2-benzimidazolone IUPAC Name: 1-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-3-ethylbenzimidazol-2-one Traditional Name: 1-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-3-ethyl-benzimidazol-2-one Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCC4=CC(=C(C=C4C3)OCC)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCC4=CC(=C(C=C4C3)OCC)OCC

InChI

InChI=1S/C25H31N3O4/c1-4-27-20-9-7-8-10-21(20)28(25(27)30)14-12-24(29)26-13-11-18-15-22(31-5-2)23(32-6-3)16-19(18)17-26/h7-10,15-16H,4-6,11-14,17H2,1-3H3