6-chloranyl-3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-1,3-benzoxazol-2-one Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O)OC

InChI

InChI=1S/C21H21ClN2O5/c1-27-18-9-13-5-7-23(12-14(13)10-19(18)28-2)20(25)6-8-24-16-4-3-15(22)11-17(16)29-21(24)26/h3-4,9-11H,5-8,12H2,1-2H3