methyl 4-methyl-2-[(4-methyl-2-nitro-phenoxy)methyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[(4-methyl-2-nitro-phenoxy)methyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[(4-methyl-2-nitro-phenoxy)methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[(4-methyl-2-nitrophenoxy)methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-methyl-2-nitrophenoxy)methyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[(4-methyl-2-nitro-phenoxy)methyl]quinoline-3-carboxylic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C(=C2C(=O)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C(=C2C(=O)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O5/c1-12-8-9-18(17(10-12)22(24)25)27-11-16-19(20(23)26-3)13(2)14-6-4-5-7-15(14)21-16/h4-10H,11H2,1-3H3