6-methoxy-2-[2-(4-nitrophenyl)ethyl]-5-pentoxy-isoquinolin-1-one

Systemtic Name: 6-methoxy-2-[2-(4-nitrophenyl)ethyl]-5-pentoxy-isoquinolin-1-one Openeye Name: 6-methoxy-2-[2-(4-nitrophenyl)ethyl]-5-pentoxy-isoquinolin-1-one CAS Name: 6-methoxy-2-[2-(4-nitrophenyl)ethyl]-5-pentoxy-1-isoquinolinone IUPAC Name: 6-methoxy-2-[2-(4-nitrophenyl)ethyl]-5-pentoxyisoquinolin-1-one Traditional Name: 5-amoxy-6-methoxy-2-[2-(4-nitrophenyl)ethyl]isocarbostyril Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC2=C1C=CN(C2=O)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCOC1=C(C=CC2=C1C=CN(C2=O)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H26N2O5/c1-3-4-5-16-30-22-19-13-15-24(23(26)20(19)10-11-21(22)29-2)14-12-17-6-8-18(9-7-17)25(27)28/h6-11,13,15H,3-5,12,14,16H2,1-2H3