[4-[2-(6-methoxy-1-oxidanylidene-7-pentoxy-isoquinolin-2-yl)ethyl]phenyl] ethanoate

Systemtic Name: [4-[2-(6-methoxy-1-oxidanylidene-7-pentoxy-isoquinolin-2-yl)ethyl]phenyl] ethanoate Openeye Name: [4-[2-(6-methoxy-1-oxo-7-pentoxy-2-isoquinolyl)ethyl]phenyl] acetate CAS Name: acetic acid [4-[2-(6-methoxy-1-oxo-7-pentoxy-2-isoquinolinyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(6-methoxy-1-oxo-7-pentoxyisoquinolin-2-yl)ethyl]phenyl] acetate Traditional Name: acetic acid [4-[2-(7-amoxy-1-keto-6-methoxy-2-isoquinolyl)ethyl]phenyl] ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C2C=CN(C(=O)C2=C1)CCC3=CC=C(C=C3)OC(=O)C)OC

Isomeric SMILES

CCCCCOC1=C(C=C2C=CN(C(=O)C2=C1)CCC3=CC=C(C=C3)OC(=O)C)OC

InChI

InChI=1S/C25H29NO5/c1-4-5-6-15-30-24-17-22-20(16-23(24)29-3)12-14-26(25(22)28)13-11-19-7-9-21(10-8-19)31-18(2)27/h7-10,12,14,16-17H,4-6,11,13,15H2,1-3H3