ethyl 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxidanylidene-propyl]-1-oxidanylidene-isoquinolin-5-yl]oxypropanoate

Systemtic Name: ethyl 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxidanylidene-propyl]-1-oxidanylidene-isoquinolin-5-yl]oxypropanoate Openeye Name: ethyl 2-[[2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxo-propyl]-1-oxo-5-isoquinolyl]oxy]propanoate CAS Name: 2-[[2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxopropyl]-1-oxo-5-isoquinolinyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxopropyl]-1-oxoisoquinolin-5-yl]oxypropanoate Traditional Name: 2-[[2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-keto-propyl]-1-keto-5-isoquinolyl]oxy]propionic acid ethyl ester Formula: C25H26N2O7 MolecularWeight: 466.48314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CCC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CCC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C25H26N2O7/c1-3-31-25(30)16(2)34-20-6-4-5-19-18(20)9-11-27(24(19)29)12-10-23(28)26-17-7-8-21-22(15-17)33-14-13-32-21/h4-9,11,15-16H,3,10,12-14H2,1-2H3,(H,26,28)