1-isoquinolin-5-yl-3-[1-(4-nitrophenoxy)propan-2-yl]urea

Systemtic Name: 1-isoquinolin-5-yl-3-[1-(4-nitrophenoxy)propan-2-yl]urea Openeye Name: 1-(5-isoquinolyl)-3-[1-methyl-2-(4-nitrophenoxy)ethyl]urea CAS Name: 1-(5-isoquinolinyl)-3-[1-(4-nitrophenoxy)propan-2-yl]urea IUPAC Name: 1-isoquinolin-5-yl-3-[1-(4-nitrophenoxy)propan-2-yl]urea Traditional Name: 1-(5-isoquinolyl)-3-[1-methyl-2-(4-nitrophenoxy)ethyl]urea Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(COC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H18N4O4/c1-13(12-27-16-7-5-15(6-8-16)23(25)26)21-19(24)22-18-4-2-3-14-11-20-10-9-17(14)18/h2-11,13H,12H2,1H3,(H2,21,22,24)