(4-aminocarbonyl-2-nitro-phenyl)methyl 6-chloranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 6-chloranyl-2-methyl-quinoline-3-carboxylate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 6-chloro-2-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-3-quinolinecarboxylic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 6-chloro-2-methylquinoline-3-carboxylate Traditional Name: 6-chloro-2-methyl-quinoline-3-carboxylic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C19H14ClN3O5 MolecularWeight: 399.78456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H14ClN3O5/c1-10-15(7-13-6-14(20)4-5-16(13)22-10)19(25)28-9-12-3-2-11(18(21)24)8-17(12)23(26)27/h2-8H,9H2,1H3,(H2,21,24)