(phenylmethyl) (2R)-6-chloranyl-3-methanoyl-2-(4-nitrophenyl)-2H-quinoline-1-carboxylate

Systemtic Name: (phenylmethyl) (2R)-6-chloranyl-3-methanoyl-2-(4-nitrophenyl)-2H-quinoline-1-carboxylate Openeye Name: benzyl (2R)-6-chloro-3-formyl-2-(4-nitrophenyl)-2H-quinoline-1-carboxylate CAS Name: (2R)-6-chloro-3-formyl-2-(4-nitrophenyl)-2H-quinoline-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-6-chloro-3-formyl-2-(4-nitrophenyl)-2H-quinoline-1-carboxylate Traditional Name: (2R)-6-chloro-3-formyl-2-(4-nitrophenyl)-2H-quinoline-1-carboxylic acid benzyl ester Formula: C24H17ClN2O5 MolecularWeight: 448.85518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C(C(=CC3=C2C=CC(=C3)Cl)C=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2[C@@H](C(=CC3=C2C=CC(=C3)Cl)C=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H17ClN2O5/c25-20-8-11-22-18(13-20)12-19(14-28)23(17-6-9-21(10-7-17)27(30)31)26(22)24(29)32-15-16-4-2-1-3-5-16/h1-14,23H,15H2/t23-/m1/s1