methyl 2-[(3-azanyl-4-chloranyl-phenyl)carbonyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(3-azanyl-4-chloranyl-phenyl)carbonyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(3-amino-4-chloro-benzoyl)oxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[(3-amino-4-chlorophenyl)-oxomethoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-amino-4-chlorobenzoyl)oxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[(3-amino-4-chloro-benzoyl)oxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C25H19ClN2O4 MolecularWeight: 446.88236

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C=C3)Cl)N)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C=C3)Cl)N)C4=CC=CC=C4

InChI

InChI=1S/C25H19ClN2O4/c1-31-25(30)23-21(14-32-24(29)16-11-12-18(26)19(27)13-16)28-20-10-6-5-9-17(20)22(23)15-7-3-2-4-8-15/h2-13H,14,27H2,1H3